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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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1 – 15 of 291 results
1

(+)-3-Carene

CAS: 498-15-7 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00066417 InChI Key: BQOFWKZOCNGFEC-BDAKNGLRSA-N IUPAC Name: (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene SMILES: CC1=CC[C@@H]2[C@H](C1)C2(C)C

CAS 498-15-7
Molecular Weight (g/mol) 136.24
MDL Number MFCD00066417
SMILES CC1=CC[C@@H]2[C@H](C1)C2(C)C
IUPAC Name (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene
InChI Key BQOFWKZOCNGFEC-BDAKNGLRSA-N
Molecular Formula C10H16
2

TraceCERT™ Verbenon, 2000 μg/mL, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

3

(-)-Menthone, Terpene Analytical Standard, MilliporeSigma™ Supelco™

Boiling Point 207°C to 210°C (literature)
Linear Formula C10H18O
Physical Form Neat
Grade Analytical Standard
Density 0.893 g/mL (at 20°C (literature))
Vapor Pressure 0.5 mmHg (20°C)
Optical Rotation [α]20/D -28 ±2°, Neat
Percent Purity ≥99% (Sum of Enantiomers, GC)
CAS 14073-97-3
MDL Number MFCD00001634
Flash Point 74°C
Health Hazard 1 H315 - H317
Refractive Index n20/D 1.45 (literature); n20/D 1.451
Synonym (1 R,4 S)-p-Menthan-3-one; (2 S,5 R)-2-Isopropyl-5-methylcyclohexanone
Recommended Storage 2°C to 8°C
Shelf Life Limited shelf life, expiry date on the label
Molecular Formula C10H18O
Formula Weight 154.25
4

(1S,2S,3R,5S)-(+)-2,3-Pinanediol, 98%

CAS: 18680-27-8 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.25 MDL Number: MFCD00077851 InChI Key: MOILFCKRQFQVFS-OORONAJNSA-N Synonym: 1s,2s,3r,5s-+-2,3-pinanediol,1s,2s,3r,5s-2,6,6-trimethylbicyclo 3.1.1 heptane-2,3-diol,1s,2s,3r,5s-+-pinanediol,+-pinanediol,pinanediol, +,unii-y6zcv4avra,+-2-hydroxyisopinocampheol,y6zcv4avra,1s,2s,3r,5s-2,3-pinanediol,bicyclo 3.1.1 heptane-2,3-diol, 2,6,6-trimethyl-, 1s,2s,3r,5s PubChem CID: 10219606 IUPAC Name: (1S,3R,4S,5S)-4,6,6-trimethylbicyclo[3.1.1]heptane-3,4-diol SMILES: CC1(C2CC1C(C(C2)O)(C)O)C

PubChem CID 10219606
CAS 18680-27-8
Molecular Weight (g/mol) 170.25
MDL Number MFCD00077851
SMILES CC1(C2CC1C(C(C2)O)(C)O)C
Synonym 1s,2s,3r,5s-+-2,3-pinanediol,1s,2s,3r,5s-2,6,6-trimethylbicyclo 3.1.1 heptane-2,3-diol,1s,2s,3r,5s-+-pinanediol,+-pinanediol,pinanediol, +,unii-y6zcv4avra,+-2-hydroxyisopinocampheol,y6zcv4avra,1s,2s,3r,5s-2,3-pinanediol,bicyclo 3.1.1 heptane-2,3-diol, 2,6,6-trimethyl-, 1s,2s,3r,5s
IUPAC Name (1S,3R,4S,5S)-4,6,6-trimethylbicyclo[3.1.1]heptane-3,4-diol
InChI Key MOILFCKRQFQVFS-OORONAJNSA-N
Molecular Formula C10H18O2
5

Citral, 95%, mixture of cis and trans

CAS: 5392-40-5 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00006997 InChI Key: WTEVQBCEXWBHNA-JXMROGBWSA-N Synonym: citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb PubChem CID: 638011 ChEBI: CHEBI:16980 IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal SMILES: CC(C)=CCC\C(C)=C\C=O

PubChem CID 638011
CAS 5392-40-5
Molecular Weight (g/mol) 152.24
ChEBI CHEBI:16980
MDL Number MFCD00006997
SMILES CC(C)=CCC\C(C)=C\C=O
Synonym citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb
IUPAC Name (2E)-3,7-dimethylocta-2,6-dienal
InChI Key WTEVQBCEXWBHNA-JXMROGBWSA-N
Molecular Formula C10H16O
6

Linalool, 97%

CAS: 78-70-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00008906 InChI Key: CDOSHBSSFJOMGT-UHFFFAOYSA-N Synonym: linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool PubChem CID: 6549 ChEBI: CHEBI:17580 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-ol SMILES: CC(=CCCC(C)(C=C)O)C

PubChem CID 6549
CAS 78-70-6
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:17580
MDL Number MFCD00008906
SMILES CC(=CCCC(C)(C=C)O)C
Synonym linalool,linalol,3,7-dimethyl-1,6-octadien-3-ol,allo-ocimenol,beta-linalool,linalyl alcohol,1,6-octadien-3-ol, 3,7-dimethyl,+--linalool,p-linalool,linanool
IUPAC Name 3,7-dimethylocta-1,6-dien-3-ol
InChI Key CDOSHBSSFJOMGT-UHFFFAOYSA-N
Molecular Formula C10H18O
7

D(+)-10-Camphorsulfonic acid, 99%

CAS: 3144-16-9 Molecular Formula: C10H15O4S Molecular Weight (g/mol): 231.29 MDL Number: MFCD00064157,MFCD00074827 InChI Key: MIOPJNTWMNEORI-XVKPBYJWSA-M Synonym: 1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,d-camphorsulfonic acid,r-camphorsulfonic acid,unii-9tlz01s15l,d-+-10-camphorsulfonic acid,d-+-camphor-10-sulfonic acid,dl-10-camphorsulfonic acid,camphor-10-sulfonic acid,camphersulfosaeure german,d-camphor-10-sulfonic acid PubChem CID: 65617 ChEBI: CHEBI:55403 IUPAC Name: [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid SMILES: CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2

PubChem CID 65617
CAS 3144-16-9
Molecular Weight (g/mol) 231.29
ChEBI CHEBI:55403
MDL Number MFCD00064157,MFCD00074827
SMILES CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2
Synonym 1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,d-camphorsulfonic acid,r-camphorsulfonic acid,unii-9tlz01s15l,d-+-10-camphorsulfonic acid,d-+-camphor-10-sulfonic acid,dl-10-camphorsulfonic acid,camphor-10-sulfonic acid,camphersulfosaeure german,d-camphor-10-sulfonic acid
IUPAC Name [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid
InChI Key MIOPJNTWMNEORI-XVKPBYJWSA-M
Molecular Formula C10H15O4S
8

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
9

DL-Camphor, 96%

CAS: 76-22-2 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00074738,MFCD00064149 InChI Key: DSSYKIVIOFKYAU-UHFFFAOYNA-N Synonym: camphor,dl-camphor,2-camphanone,2-bornanone,l---camphor,+/--camphor,root bark oil,1,7,7-trimethylbicyclo 2.2.1 heptan-2-one,bornan-2-one,alphanon PubChem CID: 2537 ChEBI: CHEBI:36773 IUPAC Name: 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one SMILES: CC1(C)C2CCC1(C)C(=O)C2

PubChem CID 2537
CAS 76-22-2
Molecular Weight (g/mol) 152.24
ChEBI CHEBI:36773
MDL Number MFCD00074738,MFCD00064149
SMILES CC1(C)C2CCC1(C)C(=O)C2
Synonym camphor,dl-camphor,2-camphanone,2-bornanone,l---camphor,+/--camphor,root bark oil,1,7,7-trimethylbicyclo 2.2.1 heptan-2-one,bornan-2-one,alphanon
IUPAC Name 4,7,7-trimethylbicyclo[2.2.1]heptan-3-one
InChI Key DSSYKIVIOFKYAU-UHFFFAOYNA-N
Molecular Formula C10H16O
10

Geranyl bromide, 96%

CAS: 6138-90-5 Molecular Formula: C10H17Br Molecular Weight (g/mol): 217.15 MDL Number: MFCD00000243 InChI Key: JSCUZAYKVZXKQE-JXMROGBWSA-N Synonym: geranyl bromide,e-1-bromo-3,7-dimethylocta-2,6-diene,2,6-octadiene, 1-bromo-3,7-dimethyl-, e,2,6-octadiene, 1-bromo-3,7-dimethyl-, 2e,geranylbromide,2e-1-bromo-3,7-dimethyl-2,6-octadiene,6e-8-bromo-2,6-dimethylocta-2,6-diene,1-bromo-3,7-dimethyl-2,6-octadiene,trans-geranyl bromide,e-geranyl bromide PubChem CID: 5365867 IUPAC Name: (2E)-1-bromo-3,7-dimethylocta-2,6-diene SMILES: CC(=CCCC(=CCBr)C)C

PubChem CID 5365867
CAS 6138-90-5
Molecular Weight (g/mol) 217.15
MDL Number MFCD00000243
SMILES CC(=CCCC(=CCBr)C)C
Synonym geranyl bromide,e-1-bromo-3,7-dimethylocta-2,6-diene,2,6-octadiene, 1-bromo-3,7-dimethyl-, e,2,6-octadiene, 1-bromo-3,7-dimethyl-, 2e,geranylbromide,2e-1-bromo-3,7-dimethyl-2,6-octadiene,6e-8-bromo-2,6-dimethylocta-2,6-diene,1-bromo-3,7-dimethyl-2,6-octadiene,trans-geranyl bromide,e-geranyl bromide
IUPAC Name (2E)-1-bromo-3,7-dimethylocta-2,6-diene
InChI Key JSCUZAYKVZXKQE-JXMROGBWSA-N
Molecular Formula C10H17Br
11

1,4-Diisopropylbenzene, 99%

CAS: 100-18-5 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.28 MDL Number: MFCD00008892 InChI Key: SPPWGCYEYAMHDT-UHFFFAOYSA-N Synonym: 1,4-diisopropylbenzene,p-diisopropylbenzene,benzene, p-diisopropyl,benzene, 1,4-bis 1-methylethyl,para-diisopropylbenzene,p-diisopropylbenzol,1,4-bis 1-methylethyl benzene,unii-5m62031nzp,1,4-di propan-2-yl benzene,dsstox_cid_6652 PubChem CID: 7486 SMILES: CC(C)C1=CC=C(C=C1)C(C)C

PubChem CID 7486
CAS 100-18-5
Molecular Weight (g/mol) 162.28
MDL Number MFCD00008892
SMILES CC(C)C1=CC=C(C=C1)C(C)C
Synonym 1,4-diisopropylbenzene,p-diisopropylbenzene,benzene, p-diisopropyl,benzene, 1,4-bis 1-methylethyl,para-diisopropylbenzene,p-diisopropylbenzol,1,4-bis 1-methylethyl benzene,unii-5m62031nzp,1,4-di propan-2-yl benzene,dsstox_cid_6652
InChI Key SPPWGCYEYAMHDT-UHFFFAOYSA-N
Molecular Formula C12H18
12

2,6-Di-tert-butyl-p-benzoquinone, 98%

CAS: 719-22-2 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.31 MDL Number: MFCD00001601 InChI Key: RDQSIADLBQFVMY-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone PubChem CID: 12867 IUPAC Name: 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione SMILES: CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C

PubChem CID 12867
CAS 719-22-2
Molecular Weight (g/mol) 220.31
MDL Number MFCD00001601
SMILES CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C
Synonym 2,6-di-tert-butyl-p-benzoquinone,2,6-di-tert-butyl-1,4-benzoquinone,2,6-di-tert-butylcyclohexa-2,5-diene-1,4-dione,2,6-di-tert-butylbenzoquinone,2,6-di-tert-butylquinone,2,6-di-t-butyl-p-benzoquinone,2,5-cyclohexadiene-1,4-dione, 2,6-bis 1,1-dimethylethyl,p-benzoquinone, 2,6-di-tert-butyl,unii-4c9d8l0y0t,2,6-di tert-butyl benzo-1,4-quinone
IUPAC Name 2,6-ditert-butylcyclohexa-2,5-diene-1,4-dione
InChI Key RDQSIADLBQFVMY-UHFFFAOYSA-N
Molecular Formula C14H20O2
13

L-Menthone, 97%

CAS: 14073-97-3 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00001634,MFCD00136033 InChI Key: NFLGAXVYCFJBMK-BDAKNGLRSA-N Synonym: --menthone,l-menthone,menthone,trans-menthone,p-menthone,neomenthone,menthone racemic,trans-p-menthan-3-one,2s,5r-2-isopropyl-5-methylcyclohexanone,l-menthan-3-one PubChem CID: 26447 ChEBI: CHEBI:15410 IUPAC Name: (2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-one SMILES: CC(C)[C@@H]1CC[C@@H](C)CC1=O

PubChem CID 26447
CAS 14073-97-3
Molecular Weight (g/mol) 154.25
ChEBI CHEBI:15410
MDL Number MFCD00001634,MFCD00136033
SMILES CC(C)[C@@H]1CC[C@@H](C)CC1=O
Synonym --menthone,l-menthone,menthone,trans-menthone,p-menthone,neomenthone,menthone racemic,trans-p-menthan-3-one,2s,5r-2-isopropyl-5-methylcyclohexanone,l-menthan-3-one
IUPAC Name (2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-one
InChI Key NFLGAXVYCFJBMK-BDAKNGLRSA-N
Molecular Formula C10H18O
14

Citronellol, 95%

CAS: 106-22-9 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.27 MDL Number: MFCD00002935 InChI Key: QMVPMAAFGQKVCJ-UHFFFAOYSA-N Synonym: citronellol,beta-citronellol,3,7-dimethyl-6-octen-1-ol,dl-citronellol,cephrol,elenol,6-octen-1-ol, 3,7-dimethyl,rodinol,2,3-dihydrogeraniol,2,6-dimethyl-2-octen-8-ol PubChem CID: 8842 ChEBI: CHEBI:50462 IUPAC Name: 3,7-dimethyloct-6-en-1-ol SMILES: CC(CCC=C(C)C)CCO

PubChem CID 8842
CAS 106-22-9
Molecular Weight (g/mol) 156.27
ChEBI CHEBI:50462
MDL Number MFCD00002935
SMILES CC(CCC=C(C)C)CCO
Synonym citronellol,beta-citronellol,3,7-dimethyl-6-octen-1-ol,dl-citronellol,cephrol,elenol,6-octen-1-ol, 3,7-dimethyl,rodinol,2,3-dihydrogeraniol,2,6-dimethyl-2-octen-8-ol
IUPAC Name 3,7-dimethyloct-6-en-1-ol
InChI Key QMVPMAAFGQKVCJ-UHFFFAOYSA-N
Molecular Formula C10H20O
15

DL-Camphoroquinone, 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