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Monoterpenoids

A diverse, modified class of terpenoids comprising two isoprene units and containing oxygen functionality or missing a methyl group; they have relevance to the pharmaceutical, cosmetic, agricultural, and food industries.
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Keyword Search:
1 – 15 of 287 results
1

Geraniol, 99%

CAS: 106-24-1 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 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) 154.25
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
2

Citronellal, 95+%

CAS: 106-23-0 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00038090 InChI Key: NEHNMFOYXAPHSD-SNVBAGLBSA-N Synonym: citronellal,rhodinal,3,7-dimethyl-6-octenal,2,3-dihydrocitral,6-octenal, 3,7-dimethyl,citronellel,citronella,3,7-dimethyl-6-octen-1-al,beta-citronellal,d-rhodinal PubChem CID: 7794 ChEBI: CHEBI:47856 IUPAC Name: 3,7-dimethyloct-6-enal SMILES: C[C@H](CCC=C(C)C)CC=O

PubChem CID 7794
CAS 106-23-0
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:47856
MDL Number MFCD00038090
SMILES C[C@H](CCC=C(C)C)CC=O
Synonym citronellal,rhodinal,3,7-dimethyl-6-octenal,2,3-dihydrocitral,6-octenal, 3,7-dimethyl,citronellel,citronella,3,7-dimethyl-6-octen-1-al,beta-citronellal,d-rhodinal
IUPAC Name 3,7-dimethyloct-6-enal
InChI Key NEHNMFOYXAPHSD-SNVBAGLBSA-N
Molecular Formula C10H18O
3

p-Cymene, 99+%

CAS: 99-87-6 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00008893 InChI Key: HFPZCAJZSCWRBC-UHFFFAOYSA-N Synonym: p-cymene,4-isopropyltoluene,p-isopropyltoluene,dolcymene,p-cymol,paracymene,cymene,para-cymene,1-isopropyl-4-methylbenzene,camphogen PubChem CID: 7463 ChEBI: CHEBI:28768 IUPAC Name: 1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C

PubChem CID 7463
CAS 99-87-6
Molecular Weight (g/mol) 134.22
ChEBI CHEBI:28768
MDL Number MFCD00008893
SMILES CC1=CC=C(C=C1)C(C)C
Synonym p-cymene,4-isopropyltoluene,p-isopropyltoluene,dolcymene,p-cymol,paracymene,cymene,para-cymene,1-isopropyl-4-methylbenzene,camphogen
IUPAC Name 1-methyl-4-propan-2-ylbenzene
InChI Key HFPZCAJZSCWRBC-UHFFFAOYSA-N
Molecular Formula C10H14
4

alpha-Terpineol, 95%, mixture of alpha- and gamma-terpineol

CAS: 98-55-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001557 InChI Key: WUOACPNHFRMFPN-UHFFFAOYSA-N Synonym: alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol PubChem CID: 17100 ChEBI: CHEBI:22469 IUPAC Name: 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol SMILES: CC1=CCC(CC1)C(C)(C)O

PubChem CID 17100
CAS 98-55-5
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:22469
MDL Number MFCD00001557
SMILES CC1=CCC(CC1)C(C)(C)O
Synonym alpha-terpineol,terpineol,p-menth-1-en-8-ol,2-4-methylcyclohex-3-en-1-yl propan-2-ol,dl-alpha-terpineol,1-p-menthen-8-ol,1-menthene-8-ol,terpineol schlechthin,carvomenthenol,terpenol
IUPAC Name 2-(4-methylcyclohex-3-en-1-yl)propan-2-ol
InChI Key WUOACPNHFRMFPN-UHFFFAOYSA-N
Molecular Formula C10H18O
5

4-Isopropylbenzaldehyde, 98%

CAS: 122-03-2 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00006953 InChI Key: WTWBUQJHJGUZCY-UHFFFAOYSA-N Synonym: 4-isopropylbenzaldehyde,cuminaldehyde,cuminic aldehyde,cumaldehyde,cuminal,p-cumic aldehyde,cumic aldehyde,cuminyl aldehyde,p-isopropylbenzaldehyde,benzaldehyde, 4-1-methylethyl PubChem CID: 326 ChEBI: CHEBI:28671 IUPAC Name: 4-propan-2-ylbenzaldehyde SMILES: CC(C)C1=CC=C(C=O)C=C1

PubChem CID 326
CAS 122-03-2
Molecular Weight (g/mol) 148.21
ChEBI CHEBI:28671
MDL Number MFCD00006953
SMILES CC(C)C1=CC=C(C=O)C=C1
Synonym 4-isopropylbenzaldehyde,cuminaldehyde,cuminic aldehyde,cumaldehyde,cuminal,p-cumic aldehyde,cumic aldehyde,cuminyl aldehyde,p-isopropylbenzaldehyde,benzaldehyde, 4-1-methylethyl
IUPAC Name 4-propan-2-ylbenzaldehyde
InChI Key WTWBUQJHJGUZCY-UHFFFAOYSA-N
Molecular Formula C10H12O
6

D(+)-Carvone, 98%, synthetic

CAS: 2244-16-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00062997 InChI Key: ULDHMXUKGWMISQ-VIFPVBQESA-N Synonym: d-carvone,+-carvone,s-+-carvone,s-carvone,s-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,+-s-carvone,carvone, +,d +-carvone,carvol,s-+-p-mentha-6,8-dien-2-one PubChem CID: 16724 ChEBI: CHEBI:15399 IUPAC Name: (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one SMILES: CC1=CCC(CC1=O)C(=C)C

PubChem CID 16724
CAS 2244-16-8
Molecular Weight (g/mol) 150.22
ChEBI CHEBI:15399
MDL Number MFCD00062997
SMILES CC1=CCC(CC1=O)C(=C)C
Synonym d-carvone,+-carvone,s-+-carvone,s-carvone,s-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,+-s-carvone,carvone, +,d +-carvone,carvol,s-+-p-mentha-6,8-dien-2-one
IUPAC Name (5S)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one
InChI Key ULDHMXUKGWMISQ-VIFPVBQESA-N
Molecular Formula C10H14O
7

4-Isopropylbenzyl alcohol, 97%

CAS: 536-60-7 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00004663 InChI Key: OIGWAXDAPKFNCQ-UHFFFAOYSA-N Synonym: 4-isopropylbenzyl alcohol,cuminol,cumic alcohol,cuminyl alcohol,cuminic alcohol,4-isopropylphenyl methanol,cumyl alcohol,p-cymen-7-ol,cumin alcohol,p-isopropylbenzyl alcohol PubChem CID: 325 ChEBI: CHEBI:27628 IUPAC Name: (4-propan-2-ylphenyl)methanol SMILES: CC(C)C1=CC=C(C=C1)CO

PubChem CID 325
CAS 536-60-7
Molecular Weight (g/mol) 150.22
ChEBI CHEBI:27628
MDL Number MFCD00004663
SMILES CC(C)C1=CC=C(C=C1)CO
Synonym 4-isopropylbenzyl alcohol,cuminol,cumic alcohol,cuminyl alcohol,cuminic alcohol,4-isopropylphenyl methanol,cumyl alcohol,p-cymen-7-ol,cumin alcohol,p-isopropylbenzyl alcohol
IUPAC Name (4-propan-2-ylphenyl)methanol
InChI Key OIGWAXDAPKFNCQ-UHFFFAOYSA-N
Molecular Formula C10H14O
8

(R)-(+)-Limonene, 96%

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 IUPAC Name: (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene 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
IUPAC Name (4R)-1-methyl-4-prop-1-en-2-ylcyclohexene
InChI Key XMGQYMWWDOXHJM-JTQLQIEISA-N
Molecular Formula C10H16
9

L(-)-Carvone, 99%

CAS: 6485-40-1 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00001578 InChI Key: ULDHMXUKGWMISQ-SECBINFHSA-N Synonym: --carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone PubChem CID: 439570 ChEBI: CHEBI:15400 IUPAC Name: (5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one SMILES: CC(=C)[C@@H]1CC=C(C)C(=O)C1

PubChem CID 439570
CAS 6485-40-1
Molecular Weight (g/mol) 150.22
ChEBI CHEBI:15400
MDL Number MFCD00001578
SMILES CC(=C)[C@@H]1CC=C(C)C(=O)C1
Synonym --carvone,l-carvone,r---carvone,l--carvone,r-2-methyl-5-prop-1-en-2-yl cyclohex-2-enone,4r-carvone,levo-carvone,--p-mentha-6,8-dien-2-one,--r-carvone
IUPAC Name (5R)-2-methyl-5-prop-1-en-2-ylcyclohex-2-en-1-one
InChI Key ULDHMXUKGWMISQ-SECBINFHSA-N
Molecular Formula C10H14O
10

(1S)-(-)-beta-Pinene, 99%

CAS: 18172-67-3 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.238 MDL Number: MFCD00001345 InChI Key: WTARULDDTDQWMU-IUCAKERBSA-N Synonym: --beta-pinene,--nopinene,1s,5s-6,6-dimethyl-2-methylenebicyclo 3.1.1 heptane,1s---beta-pinene,--b-pinene,--pin-2 10-ene,unii-afn153a7su,--?-pinene,1s-1-beta-pinene,afn153a7su PubChem CID: 440967 ChEBI: CHEBI:28359 IUPAC Name: (1S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane SMILES: CC1(C2CCC(=C)C1C2)C

PubChem CID 440967
CAS 18172-67-3
Molecular Weight (g/mol) 136.238
ChEBI CHEBI:28359
MDL Number MFCD00001345
SMILES CC1(C2CCC(=C)C1C2)C
Synonym --beta-pinene,--nopinene,1s,5s-6,6-dimethyl-2-methylenebicyclo 3.1.1 heptane,1s---beta-pinene,--b-pinene,--pin-2 10-ene,unii-afn153a7su,--?-pinene,1s-1-beta-pinene,afn153a7su
IUPAC Name (1S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane
InChI Key WTARULDDTDQWMU-IUCAKERBSA-N
Molecular Formula C10H16
11

(+/-)-Camphorquinone, 99%

CAS: 10373-78-1 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00064160 InChI Key: VNQXSTWCDUXYEZ-UHFFFAOYSA-N Synonym: camphorquinone,dl-camphorquinone,camphoroquinone,2,3-bornanedione,camphor quinone,camphoquinone,1,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione,bornane-2,3-dione,bicyclo 2.2.1 heptane-2,3-dione, 1,7,7-trimethyl,+/--camphorquinone PubChem CID: 25208 ChEBI: CHEBI:34607 IUPAC Name: 4,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione SMILES: CC1(C2CCC1(C(=O)C2=O)C)C

PubChem CID 25208
CAS 10373-78-1
Molecular Weight (g/mol) 166.22
ChEBI CHEBI:34607
MDL Number MFCD00064160
SMILES CC1(C2CCC1(C(=O)C2=O)C)C
Synonym camphorquinone,dl-camphorquinone,camphoroquinone,2,3-bornanedione,camphor quinone,camphoquinone,1,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione,bornane-2,3-dione,bicyclo 2.2.1 heptane-2,3-dione, 1,7,7-trimethyl,+/--camphorquinone
IUPAC Name 4,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione
InChI Key VNQXSTWCDUXYEZ-UHFFFAOYSA-N
Molecular Formula C10H14O2
12

Menthofuran, 95%

CAS: 494-90-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 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) 150.22
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
13

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
14

(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
15

4-Chloro-2-isopropyl-5-methylphenol, 99%

CAS: 89-68-9 Molecular Formula: C10H13ClO Molecular Weight (g/mol): 184.66 MDL Number: MFCD00002326 InChI Key: KFZXVMNBUMVKLN-UHFFFAOYSA-N Synonym: chlorothymol,6-chlorothymol,4-chloro-2-isopropyl-5-methylphenol,chlorthymol,4-chlorothymol,thymol, 6-chloro,phenol, 4-chloro-5-methyl-2-1-methylethyl,caswell no. 216,4-chloro-6-isopropyl-3-methylphenol,unii-lj25ti0cvt PubChem CID: 6982 IUPAC Name: 4-chloro-5-methyl-2-propan-2-ylphenol SMILES: CC(C)C1=CC(Cl)=C(C)C=C1O

PubChem CID 6982
CAS 89-68-9
Molecular Weight (g/mol) 184.66
MDL Number MFCD00002326
SMILES CC(C)C1=CC(Cl)=C(C)C=C1O
Synonym chlorothymol,6-chlorothymol,4-chloro-2-isopropyl-5-methylphenol,chlorthymol,4-chlorothymol,thymol, 6-chloro,phenol, 4-chloro-5-methyl-2-1-methylethyl,caswell no. 216,4-chloro-6-isopropyl-3-methylphenol,unii-lj25ti0cvt
IUPAC Name 4-chloro-5-methyl-2-propan-2-ylphenol
InChI Key KFZXVMNBUMVKLN-UHFFFAOYSA-N
Molecular Formula C10H13ClO