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Lipids and Lipid Derivatives

Nonpolar, water-insoluble biomolecules for energy storage, signaling, and membrane structures; include fatty acid conjugates, prenol lipids, fatty alcohols, steroids, fatty acid esters, cylcerolipids, fatty alcohol esters, and fatty acyl thioesters.
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1

Thermo Scientific Chemicals Thymolphthalein

CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.544 MDL Number: MFCD00005909 InChI Key: LDKDGDIWEUUXSH-UHFFFAOYSA-N Synonym: thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one PubChem CID: 31316 IUPAC Name: 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O

PubChem CID 31316
CAS 125-20-2
Molecular Weight (g/mol) 430.544
MDL Number MFCD00005909
SMILES CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O
Synonym thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one
IUPAC Name 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one
InChI Key LDKDGDIWEUUXSH-UHFFFAOYSA-N
Molecular Formula C28H30O4
2

4-Isopropylphenylacetic acid, 98+%

CAS: 4476-28-2 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00041035 InChI Key: RERBQXVRXYCGLT-UHFFFAOYSA-N Synonym: 4-isopropylphenylacetic acid,2-4-isopropylphenyl acetic acid,4-isopropylphenyl acetic acid,benzeneacetic acid, 4-1-methylethyl,2-4-propan-2-yl phenyl acetic acid,p-isopropyl phenyl acetic acid,4-isopropyl-phenyl-acetic acid,4-propan-2-yl phenyl acetic acid,2-4-methylethyl phenyl acetic acid,4-isopropylphenylaceticacid PubChem CID: 78230 IUPAC Name: 2-(4-propan-2-ylphenyl)acetic acid SMILES: CC(C)C1=CC=C(C=C1)CC(=O)O

PubChem CID 78230
CAS 4476-28-2
Molecular Weight (g/mol) 178.231
MDL Number MFCD00041035
SMILES CC(C)C1=CC=C(C=C1)CC(=O)O
Synonym 4-isopropylphenylacetic acid,2-4-isopropylphenyl acetic acid,4-isopropylphenyl acetic acid,benzeneacetic acid, 4-1-methylethyl,2-4-propan-2-yl phenyl acetic acid,p-isopropyl phenyl acetic acid,4-isopropyl-phenyl-acetic acid,4-propan-2-yl phenyl acetic acid,2-4-methylethyl phenyl acetic acid,4-isopropylphenylaceticacid
IUPAC Name 2-(4-propan-2-ylphenyl)acetic acid
InChI Key RERBQXVRXYCGLT-UHFFFAOYSA-N
Molecular Formula C11H14O2
3

Geraniol, 97%

CAS: 106-24-1 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00002917 InChI Key: GLZPCOQZEFWAFX-JXMROGBWSA-N Synonym: geraniol,lemonol,geranyl alcohol,trans-geraniol,e-geraniol,e-nerol,trans-3,7-dimethyl-2,6-octadien-1-ol,e-3,7-dimethylocta-2,6-dien-1-ol,2e-3,7-dimethylocta-2,6-dien-1-ol,geraniol extra PubChem CID: 637566 ChEBI: CHEBI:17447 IUPAC Name: (2E)-3,7-dimethylocta-2,6-dien-1-ol SMILES: CC(=CCCC(=CCO)C)C

PubChem CID 637566
CAS 106-24-1
Molecular Weight (g/mol) 154.253
ChEBI CHEBI:17447
MDL Number MFCD00002917
SMILES CC(=CCCC(=CCO)C)C
Synonym geraniol,lemonol,geranyl alcohol,trans-geraniol,e-geraniol,e-nerol,trans-3,7-dimethyl-2,6-octadien-1-ol,e-3,7-dimethylocta-2,6-dien-1-ol,2e-3,7-dimethylocta-2,6-dien-1-ol,geraniol extra
IUPAC Name (2E)-3,7-dimethylocta-2,6-dien-1-ol
InChI Key GLZPCOQZEFWAFX-JXMROGBWSA-N
Molecular Formula C10H18O
4

(1R,E)-(+)-Camphorquinone 3-oxime, 99%, Thermo Scientific Chemicals

CAS: 31571-14-9 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.235 MDL Number: MFCD00074848 InChI Key: YRNPDSREMSMKIY-WKEGUHRASA-N Synonym: anti-1r-+-camphorquinone3-oxime,1s,4r-2-hydroxyimino-4,7,7-trimethylbicyclo 2.2.1 heptan-3-one PubChem CID: 23308125 IUPAC Name: (1R,4R)-2-hydroxyimino-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one SMILES: CC1(C2CCC1(C(=O)C2=NO)C)C

PubChem CID 23308125
CAS 31571-14-9
Molecular Weight (g/mol) 181.235
MDL Number MFCD00074848
SMILES CC1(C2CCC1(C(=O)C2=NO)C)C
Synonym anti-1r-+-camphorquinone3-oxime,1s,4r-2-hydroxyimino-4,7,7-trimethylbicyclo 2.2.1 heptan-3-one
IUPAC Name (1R,4R)-2-hydroxyimino-4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
InChI Key YRNPDSREMSMKIY-WKEGUHRASA-N
Molecular Formula C10H15NO2
5

Norcamphor, 98+%

CAS: 497-38-1 Molecular Formula: C7H10O Molecular Weight (g/mol): 110.156 MDL Number: MFCD00074823 InChI Key: KPMKEVXVVHNIEY-UHFFFAOYSA-N Synonym: norcamphor,2-norbornanone,bicyclo 2.2.1 heptan-2-one,norcampher,2-oxonorbornane,norbornan-2-one,2,5-methanocyclohexanone,8,9,10-trinorbornan-2-one,bicyclo 2.2.1 heptan-3-one PubChem CID: 10345 IUPAC Name: bicyclo[2.2.1]heptan-3-one SMILES: C1CC2CC1CC2=O

PubChem CID 10345
CAS 497-38-1
Molecular Weight (g/mol) 110.156
MDL Number MFCD00074823
SMILES C1CC2CC1CC2=O
Synonym norcamphor,2-norbornanone,bicyclo 2.2.1 heptan-2-one,norcampher,2-oxonorbornane,norbornan-2-one,2,5-methanocyclohexanone,8,9,10-trinorbornan-2-one,bicyclo 2.2.1 heptan-3-one
IUPAC Name bicyclo[2.2.1]heptan-3-one
InChI Key KPMKEVXVVHNIEY-UHFFFAOYSA-N
Molecular Formula C7H10O
6

alpha-Pinene, 97%, stabilized with alpha-Tocopherol

CAS: 80-56-8 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00001339 InChI Key: GRWFGVWFFZKLTI-UHFFFAOYSA-N Synonym: alpha-pinene,2-pinene,.alpha.-pinene,acintene a,pinene isomer,2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,pinene, alpha,pin-2 3-ene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl,+-a-pinene PubChem CID: 6654 ChEBI: CHEBI:36740 IUPAC Name: 4,6,6-trimethylbicyclo[3.1.1]hept-3-ene SMILES: CC1=CCC2CC1C2(C)C

PubChem CID 6654
CAS 80-56-8
Molecular Weight (g/mol) 136.24
ChEBI CHEBI:36740
MDL Number MFCD00001339
SMILES CC1=CCC2CC1C2(C)C
Synonym alpha-pinene,2-pinene,.alpha.-pinene,acintene a,pinene isomer,2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,pinene, alpha,pin-2 3-ene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl,+-a-pinene
IUPAC Name 4,6,6-trimethylbicyclo[3.1.1]hept-3-ene
InChI Key GRWFGVWFFZKLTI-UHFFFAOYSA-N
Molecular Formula C10H16
7

(+)-Dihydrocarvone, 98%, mixture of isomers

CAS: 5524-05-0 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00001636 InChI Key: AZOCECCLWFDTAP-RKDXNWHRSA-N Synonym: +-dihydrocarvone,d-dihydrocarvone,1r,4r-dihydrocarvone,e-dihydrocarvone,unii-vta43h364z,2r-trans-2-methyl-5-1-methylvinyl cyclohexan-1-one,2r,5r-2-methyl-5-isopropenylcyclohexanone,2r,5r-5-isopropenyl-2-methylcyclohexanone,2r,5r-2-methyl-5-prop-1-en-2-yl cyclohexanone,cyclohexanone, 2-methyl-5-1-methylethenyl-, 2r,5r PubChem CID: 22227 ChEBI: CHEBI:154 IUPAC Name: (2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one SMILES: CC1CCC(CC1=O)C(=C)C

PubChem CID 22227
CAS 5524-05-0
Molecular Weight (g/mol) 152.24
ChEBI CHEBI:154
MDL Number MFCD00001636
SMILES CC1CCC(CC1=O)C(=C)C
Synonym +-dihydrocarvone,d-dihydrocarvone,1r,4r-dihydrocarvone,e-dihydrocarvone,unii-vta43h364z,2r-trans-2-methyl-5-1-methylvinyl cyclohexan-1-one,2r,5r-2-methyl-5-isopropenylcyclohexanone,2r,5r-5-isopropenyl-2-methylcyclohexanone,2r,5r-2-methyl-5-prop-1-en-2-yl cyclohexanone,cyclohexanone, 2-methyl-5-1-methylethenyl-, 2r,5r
IUPAC Name (2R,5R)-2-methyl-5-prop-1-en-2-ylcyclohexan-1-one
InChI Key AZOCECCLWFDTAP-RKDXNWHRSA-N
Molecular Formula C10H16O
8

D(+)-Fenchone, 97%

CAS: 4695-62-9 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00070689 InChI Key: LHXDLQBQYFFVNW-XCBNKYQSSA-N Synonym: +-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one PubChem CID: 1201521 ChEBI: CHEBI:165 IUPAC Name: (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one SMILES: CC1(C2CCC(C2)(C1=O)C)C

PubChem CID 1201521
CAS 4695-62-9
Molecular Weight (g/mol) 152.24
ChEBI CHEBI:165
MDL Number MFCD00070689
SMILES CC1(C2CCC(C2)(C1=O)C)C
Synonym +-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one
IUPAC Name (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one
InChI Key LHXDLQBQYFFVNW-XCBNKYQSSA-N
Molecular Formula C10H16O
9

L(-)-Borneol, 97%

CAS: 464-45-9 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00003759,MFCD00066426,MFCD00066427 InChI Key: DTGKSKDOIYIVQL-NQMVMOMDSA-N Synonym: --borneol,borneol,l-borneol,1s,2r,4s-1,7,7-trimethylbicyclo 2.2.1 heptan-2-ol,linderol,1s-endo---borneol,borneo camphor,bornyl alcohol,sumatra camphor,dl-borneol PubChem CID: 1201518 ChEBI: CHEBI:15394 IUPAC Name: (1S,3R,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol SMILES: CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2

PubChem CID 1201518
CAS 464-45-9
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:15394
MDL Number MFCD00003759,MFCD00066426,MFCD00066427
SMILES CC1(C)[C@@H]2CC[C@]1(C)[C@H](O)C2
Synonym --borneol,borneol,l-borneol,1s,2r,4s-1,7,7-trimethylbicyclo 2.2.1 heptan-2-ol,linderol,1s-endo---borneol,borneo camphor,bornyl alcohol,sumatra camphor,dl-borneol
IUPAC Name (1S,3R,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol
InChI Key DTGKSKDOIYIVQL-NQMVMOMDSA-N
Molecular Formula C10H18O
10

(+)-Limonene, 96%, unstabilized

CAS: 5989-27-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00062991 InChI Key: XMGQYMWWDOXHJM-JTQLQIEISA-N Synonym: d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene PubChem CID: 440917 ChEBI: CHEBI:15382 SMILES: CC(=C)[C@@H]1CCC(C)=CC1

PubChem CID 440917
CAS 5989-27-5
Molecular Weight (g/mol) 136.24
ChEBI CHEBI:15382
MDL Number MFCD00062991
SMILES CC(=C)[C@@H]1CCC(C)=CC1
Synonym d-limonene,+-limonene,r-+-limonene,+-4r-limonene,+-carvene,+-dipentene,citrene,+-p-mentha-1,8-diene,4r-limonene,d-+-limonene
InChI Key XMGQYMWWDOXHJM-JTQLQIEISA-N
Molecular Formula C10H16
11

(1R)-(-)-Menthyl glyoxylate monohydrate, 98%

CAS: 111969-64-3 Molecular Formula: C12H22O4 Molecular Weight (g/mol): 230.304 MDL Number: MFCD00792503 InChI Key: BWZMJRSMHQDFIT-KXUCPTDWSA-N Synonym: 1r,2s,5r-2-isopropyl-5-methylcyclohexyl 2,2-dihydroxyacetate,l-menthyl glyoxylate hydrate,1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl dihydroxy-acetate,l-menthyl glyoxylate,l-menthylglyoxylate hydrate,--menthyl 2,2-dihydroxyacetate,1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl di,2,2-dihydroxyacetic acid 1r,3r,4s-p-menth-3-yl ester,1r,2s,5r-5-methyl-2-propan-2-ylcyclohexyl 2,2-dihydroxyacetate,2,2-dihydroxyacetic acid 1r,2s,5r-2-isopropyl-5-methylcyclohexyl ester PubChem CID: 7373179 IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2,2-dihydroxyacetate SMILES: CC1CCC(C(C1)OC(=O)C(O)O)C(C)C

PubChem CID 7373179
CAS 111969-64-3
Molecular Weight (g/mol) 230.304
MDL Number MFCD00792503
SMILES CC1CCC(C(C1)OC(=O)C(O)O)C(C)C
Synonym 1r,2s,5r-2-isopropyl-5-methylcyclohexyl 2,2-dihydroxyacetate,l-menthyl glyoxylate hydrate,1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl dihydroxy-acetate,l-menthyl glyoxylate,l-menthylglyoxylate hydrate,--menthyl 2,2-dihydroxyacetate,1r,2s,5r-5-methyl-2-1-methylethyl cyclohexyl di,2,2-dihydroxyacetic acid 1r,3r,4s-p-menth-3-yl ester,1r,2s,5r-5-methyl-2-propan-2-ylcyclohexyl 2,2-dihydroxyacetate,2,2-dihydroxyacetic acid 1r,2s,5r-2-isopropyl-5-methylcyclohexyl ester
IUPAC Name [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 2,2-dihydroxyacetate
InChI Key BWZMJRSMHQDFIT-KXUCPTDWSA-N
Molecular Formula C12H22O4
12

Di-μ-chlorobis(p-cymene)chlororuthenium(II), 98%

CAS: 52462-29-0 Molecular Formula: C20H28Cl4Ru2 Molecular Weight (g/mol): 612.39 MDL Number: MFCD00064793 InChI Key: LAXRNWSASWOFOT-UHFFFAOYSA-J Synonym: dichloro p-cymene ruthenium ii dimer,di-mu-chloro-bis chloro p-cymene ruthenium ii,rucl2 p-cymene 2,ru p-cymene cl2 2,dichloro p-cymene ruthenium dimer,p-cymene ruthenium ii chloride dimer,dichloro-p-cymene ruthenium ii dimer PubChem CID: 10908223 IUPAC Name: dichlororuthenium;1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl

PubChem CID 10908223
CAS 52462-29-0
Molecular Weight (g/mol) 612.39
MDL Number MFCD00064793
SMILES CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl
Synonym dichloro p-cymene ruthenium ii dimer,di-mu-chloro-bis chloro p-cymene ruthenium ii,rucl2 p-cymene 2,ru p-cymene cl2 2,dichloro p-cymene ruthenium dimer,p-cymene ruthenium ii chloride dimer,dichloro-p-cymene ruthenium ii dimer
IUPAC Name dichlororuthenium;1-methyl-4-propan-2-ylbenzene
InChI Key LAXRNWSASWOFOT-UHFFFAOYSA-J
Molecular Formula C20H28Cl4Ru2
13

Isobornyl acetate, 94%

CAS: 125-12-2 Molecular Formula: C12H20O2 Molecular Weight (g/mol): 196.29 MDL Number: MFCD00867808,MFCD00135943 InChI Key: KGEKLUUHTZCSIP-JFGNBEQYSA-N Synonym: 1s,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl acetate PubChem CID: 6950273 IUPAC Name: [(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate SMILES: CC(=O)O[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C

PubChem CID 6950273
CAS 125-12-2
Molecular Weight (g/mol) 196.29
MDL Number MFCD00867808,MFCD00135943
SMILES CC(=O)O[C@H]1C[C@H]2CC[C@@]1(C)C2(C)C
Synonym 1s,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl acetate
IUPAC Name [(1S,3S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] acetate
InChI Key KGEKLUUHTZCSIP-JFGNBEQYSA-N
Molecular Formula C12H20O2
14

Ethyl chrysanthemate, 95%, mixture of cis and trans

CAS: 97-41-6 Molecular Formula: C12H20O2 Molecular Weight (g/mol): 196.29 MDL Number: MFCD00001304 InChI Key: VIMXTGUGWLAOFZ-UHFFFAOYSA-N Synonym: ethyl chrysanthemate,ethyl chrysanthemumate,chrysanthemic acid ethyl ester,cyclopropanecarboxylic acid, 2,2-dimethyl-3-2-methyl-1-propenyl-, ethyl ester,ethylchrysanthemate,ccris 2498,chrysanthemic acid, ethyl ester,ethyl 2,2-dimethyl-3-2-methyl-1-propenyl cyclopropanecarboxylate,ethyl 2,2-dimethyl-3-2-methylprop-1-en-1-yl cyclopropanecarboxylate,ethyl 2,2-dimethyl-3-2-methyl-1-propenyl cyclopropane-1-carboxylate PubChem CID: 7334 IUPAC Name: ethyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate SMILES: CCOC(=O)C1C(C1(C)C)C=C(C)C

PubChem CID 7334
CAS 97-41-6
Molecular Weight (g/mol) 196.29
MDL Number MFCD00001304
SMILES CCOC(=O)C1C(C1(C)C)C=C(C)C
Synonym ethyl chrysanthemate,ethyl chrysanthemumate,chrysanthemic acid ethyl ester,cyclopropanecarboxylic acid, 2,2-dimethyl-3-2-methyl-1-propenyl-, ethyl ester,ethylchrysanthemate,ccris 2498,chrysanthemic acid, ethyl ester,ethyl 2,2-dimethyl-3-2-methyl-1-propenyl cyclopropanecarboxylate,ethyl 2,2-dimethyl-3-2-methylprop-1-en-1-yl cyclopropanecarboxylate,ethyl 2,2-dimethyl-3-2-methyl-1-propenyl cyclopropane-1-carboxylate
IUPAC Name ethyl 2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
InChI Key VIMXTGUGWLAOFZ-UHFFFAOYSA-N
Molecular Formula C12H20O2
15

Menthofuran, 95%

CAS: 494-90-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00041851 InChI Key: YGWKXXYGDYYFJU-UHFFFAOYSA-N Synonym: menthofuran,menthofurane,3,9-epoxy-p-mentha-3,8-diene,benzofuran, 4,5,6,7-tetrahydro-3,6-dimethyl,p-mentha-3,8-diene, 3,9-epoxy,4,5,6,7-tetrahydro-3,6-dimethylbenzofuran,fema no. 3235,4,5,6,7-tetrahydro-3,6-dimethylcoumarone,r-menthofuran,3,6-dimethyl-4,5,6,7-tetrahydrobenzo 2,1-b furan PubChem CID: 329983 ChEBI: CHEBI:50542 IUPAC Name: 3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran SMILES: CC1CCC2=C(C1)OC=C2C

PubChem CID 329983
CAS 494-90-6
Molecular Weight (g/mol) 150.221
ChEBI CHEBI:50542
MDL Number MFCD00041851
SMILES CC1CCC2=C(C1)OC=C2C
Synonym menthofuran,menthofurane,3,9-epoxy-p-mentha-3,8-diene,benzofuran, 4,5,6,7-tetrahydro-3,6-dimethyl,p-mentha-3,8-diene, 3,9-epoxy,4,5,6,7-tetrahydro-3,6-dimethylbenzofuran,fema no. 3235,4,5,6,7-tetrahydro-3,6-dimethylcoumarone,r-menthofuran,3,6-dimethyl-4,5,6,7-tetrahydrobenzo 2,1-b furan
IUPAC Name 3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran
InChI Key YGWKXXYGDYYFJU-UHFFFAOYSA-N
Molecular Formula C10H14O