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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271 – 285 of 778 results

271

4-Chloro-2-isopropyl-5-methylphenol 99.0+%, TCI America™

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-yl)phenol SMILES: CC(C)C1=CC(Cl)=C(C)C=C1O

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Specifications

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-yl)phenol
InChI Key	KFZXVMNBUMVKLN-UHFFFAOYSA-N
Molecular Formula	C10H13ClO

272

beta-Citronellol 95.0+%, TCI America™

CAS: 106-22-9 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 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

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Specifications

PubChem CID	8842
CAS	106-22-9
Molecular Weight (g/mol)	156.269
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

273

(1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl (S)-2-Hydroxypropionate 98.0+%, TCI America™

CAS: 61597-98-6 Molecular Formula: C13H24O3 Molecular Weight (g/mol): 228.33 MDL Number: MFCD09037384,MFCD27977194,MFCD00589639 InChI Key: UJNOLBSYLSYIBM-UHFFFAOYNA-N Synonym: (S)-2-Hydroxypropionic Acid (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Ester, L-Menthyl L-Lactate PubChem CID: 7076215 IUPAC Name: 5-methyl-2-(propan-2-yl)cyclohexyl 2-hydroxypropanoate SMILES: CC(C)C1CCC(C)CC1OC(=O)C(C)O

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Specifications

PubChem CID	7076215
CAS	61597-98-6
Molecular Weight (g/mol)	228.33
MDL Number	MFCD09037384,MFCD27977194,MFCD00589639
SMILES	CC(C)C1CCC(C)CC1OC(=O)C(C)O
Synonym	(S)-2-Hydroxypropionic Acid (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Ester, L-Menthyl L-Lactate
IUPAC Name	5-methyl-2-(propan-2-yl)cyclohexyl 2-hydroxypropanoate
InChI Key	UJNOLBSYLSYIBM-UHFFFAOYNA-N
Molecular Formula	C13H24O3

274

(+)-Terpinen-4-ol 93.0+%, TCI America™

CAS: 2438-10-0 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00077431 InChI Key: WRYLYDPHFGVWKC-SNVBAGLBSA-N Synonym: +-terpinen-4-ol,unii-hzk34ln80n,s-p-menth-1-en-4-ol,hzk34ln80n,s-1-isopropyl-4-methyl-3-cyclohexen-1-ol,4-terpinenol, d,+-4-terpineol,4-terpineol, +,1s-1-isopropyl-4-methylcyclohex-3-en-1-ol,4-carvomenthenol, + PubChem CID: 2724161 IUPAC Name: (1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol SMILES: CC1=CCC(CC1)(C(C)C)O

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Specifications

PubChem CID	2724161
CAS	2438-10-0
Molecular Weight (g/mol)	154.253
MDL Number	MFCD00077431
SMILES	CC1=CCC(CC1)(C(C)C)O
Synonym	+-terpinen-4-ol,unii-hzk34ln80n,s-p-menth-1-en-4-ol,hzk34ln80n,s-1-isopropyl-4-methyl-3-cyclohexen-1-ol,4-terpinenol, d,+-4-terpineol,4-terpineol, +,1s-1-isopropyl-4-methylcyclohex-3-en-1-ol,4-carvomenthenol, +
IUPAC Name	(1S)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol
InChI Key	WRYLYDPHFGVWKC-SNVBAGLBSA-N
Molecular Formula	C10H18O

275

4-Isopropylbenzyl Chloride (contains ca. 10% o-form) 85.0+%, TCI America™

CAS: 2051-18-5 Molecular Formula: C10H13Cl Molecular Weight (g/mol): 168.664 MDL Number: MFCD00018885 InChI Key: CYAKWEQUWJAHLW-UHFFFAOYSA-N Synonym: 4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl PubChem CID: 74916 IUPAC Name: 1-(chloromethyl)-4-propan-2-ylbenzene SMILES: CC(C)C1=CC=C(C=C1)CCl

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Specifications

PubChem CID	74916
CAS	2051-18-5
Molecular Weight (g/mol)	168.664
MDL Number	MFCD00018885
SMILES	CC(C)C1=CC=C(C=C1)CCl
Synonym	4-isopropylbenzyl chloride,1-chloromethyl-4-isopropylbenzene,p-cymene, 7-chloro,p-isopropylbenzyl chloride,7-chloro-p-cymene,4-isopropylbenzylchloride,benzene, 1-chloromethyl-4-1-methylethyl,1-chloromethyl-4-propan-2-yl benzene,p-isopropyl benzyl chloride,benzene, 1-chloromethyl-4-methylethyl
IUPAC Name	1-(chloromethyl)-4-propan-2-ylbenzene
InChI Key	CYAKWEQUWJAHLW-UHFFFAOYSA-N
Molecular Formula	C10H13Cl

276

4-tert-Butylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™

CAS: 5451-55-8 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 MDL Number: MFCD00042622 InChI Key: QVQKEGYITJBHRQ-UHFFFAOYSA-N Synonym: trans-4-tert-butylcyclohexanecarboxylic acid,4-tert-butylcyclohexanecarboxylic acid,cis-4-tert-butylcyclohexanecarboxylic acid,trans-4-tert-butyl cyclohexanecarboxylic acid,4-tert-butyl cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl-, cis,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl,cis-4-tert-butylcyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl-, trans,qvqkegyitjbhrq-dtorhvgosa-n PubChem CID: 136759 IUPAC Name: 4-tert-butylcyclohexane-1-carboxylic acid SMILES: CC(C)(C)C1CCC(CC1)C(=O)O

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Specifications

PubChem CID	136759
CAS	5451-55-8
Molecular Weight (g/mol)	184.279
MDL Number	MFCD00042622
SMILES	CC(C)(C)C1CCC(CC1)C(=O)O
Synonym	trans-4-tert-butylcyclohexanecarboxylic acid,4-tert-butylcyclohexanecarboxylic acid,cis-4-tert-butylcyclohexanecarboxylic acid,trans-4-tert-butyl cyclohexanecarboxylic acid,4-tert-butyl cyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl-, cis,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl,cis-4-tert-butylcyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-1,1-dimethylethyl-, trans,qvqkegyitjbhrq-dtorhvgosa-n
IUPAC Name	4-tert-butylcyclohexane-1-carboxylic acid
InChI Key	QVQKEGYITJBHRQ-UHFFFAOYSA-N
Molecular Formula	C11H20O2

277

2,6-Di-tert-butyl-1,4-benzoquinone 98.0+%, TCI America™

CAS: 719-22-2 Molecular Formula: C14H20O2 Molecular Weight (g/mol): 220.312 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

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Specifications

PubChem CID	12867
CAS	719-22-2
Molecular Weight (g/mol)	220.312
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

278

(+/-)-Menthol 98.0+%, TCI America™

CAS: 89-78-1 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 MDL Number: MFCD00001484 InChI Key: NOOLISFMXDJSKH-IVZWLZJFSA-N Synonym: menthol,dl-menthol,2-isopropyl-5-methylcyclohexanol,menthyl alcohol,cyclohexanol, 5-methyl-2-1-methylethyl,p-menthan-3-ol,racementhol,caswell no. 540,3-p-menthol,+-neo-menthol PubChem CID: 6566020 IUPAC Name: (1R,2R,5S)-5-methyl-2-propan-2-ylcyclohexan-1-ol SMILES: CC1CCC(C(C1)O)C(C)C

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Specifications

PubChem CID	6566020
CAS	89-78-1
Molecular Weight (g/mol)	156.269
MDL Number	MFCD00001484
SMILES	CC1CCC(C(C1)O)C(C)C
Synonym	menthol,dl-menthol,2-isopropyl-5-methylcyclohexanol,menthyl alcohol,cyclohexanol, 5-methyl-2-1-methylethyl,p-menthan-3-ol,racementhol,caswell no. 540,3-p-menthol,+-neo-menthol
IUPAC Name	(1R,2R,5S)-5-methyl-2-propan-2-ylcyclohexan-1-ol
InChI Key	NOOLISFMXDJSKH-IVZWLZJFSA-N
Molecular Formula	C10H20O

279

3-Methylene-2-norbornanone 97.0+%, TCI America™

CAS: 5597-27-3 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.167 InChI Key: FNOOZJAPZFHNCW-UHFFFAOYSA-N Synonym: 3-Methylenebicyclo[2.2.1]heptan-2-one PubChem CID: 96875 IUPAC Name: 2-methylidenebicyclo[2.2.1]heptan-3-one SMILES: C=C1C2CCC(C2)C1=O

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Specifications

PubChem CID	96875
CAS	5597-27-3
Molecular Weight (g/mol)	122.167
SMILES	C=C1C2CCC(C2)C1=O
Synonym	3-Methylenebicyclo[2.2.1]heptan-2-one
IUPAC Name	2-methylidenebicyclo[2.2.1]heptan-3-one
InChI Key	FNOOZJAPZFHNCW-UHFFFAOYSA-N
Molecular Formula	C8H10O

280

(+)-3-Carene 90.0+%, TCI America™

CAS: 498-15-7 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.24 MDL Number: MFCD00066417 InChI Key: BQOFWKZOCNGFEC-BDAKNGLRSA-N PubChem CID: 443156 ChEBI: CHEBI:7 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

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Specifications

PubChem CID	443156
CAS	498-15-7
Molecular Weight (g/mol)	136.24
ChEBI	CHEBI:7
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

281

(1R)-(-)-Camphorquinone 98.0+%, TCI America™

CAS: 10334-26-6 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00064160,MFCD00082863,MFCD00064160,MFCD00082863 InChI Key: VNQXSTWCDUXYEZ-LDWIPMOCSA-N Synonym: 1r,4s-1,7,7-trimethylnorbornane-2,3-dione,1r,4r-4,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione,1s,4r-4,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione PubChem CID: 16211789 IUPAC Name: (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione SMILES: CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2=O

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Specifications

PubChem CID	16211789
CAS	10334-26-6
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00064160,MFCD00082863,MFCD00064160,MFCD00082863
SMILES	CC1(C)[C@@H]2CC[C@@]1(C)C(=O)C2=O
Synonym	1r,4s-1,7,7-trimethylnorbornane-2,3-dione,1r,4r-4,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione,1s,4r-4,7,7-trimethylbicyclo 2.2.1 heptane-2,3-dione
IUPAC Name	(1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione
InChI Key	VNQXSTWCDUXYEZ-LDWIPMOCSA-N
Molecular Formula	C10H14O2

282

(+/-)-10-Camphorsulfonic Acid 98.0+%, TCI America™

CAS: 8-2-5872 Molecular Formula: C10H16O4S Molecular Weight (g/mol): 232.29 MDL Number: MFCD00074827 InChI Key: MIOPJNTWMNEORI-UHFFFAOYNA-N Synonym: reychler's acid,camphorsulfonic acid,d-camphorsulfonic acid,camphersulfosaeure,--10-camphorsulfonic acid,2-oxobornane-10-sulphonic acid,d-10-camphorsulfonic acid,7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,l-camphor-10-sulfonic acid,+-10-camphorsulfonic acid PubChem CID: 18462 ChEBI: CHEBI:55379 IUPAC Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonic acid SMILES: CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C

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Specifications

PubChem CID	18462
CAS	8-2-5872
Molecular Weight (g/mol)	232.29
ChEBI	CHEBI:55379
MDL Number	MFCD00074827
SMILES	CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C
Synonym	reychler's acid,camphorsulfonic acid,d-camphorsulfonic acid,camphersulfosaeure,--10-camphorsulfonic acid,2-oxobornane-10-sulphonic acid,d-10-camphorsulfonic acid,7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonic acid,l-camphor-10-sulfonic acid,+-10-camphorsulfonic acid
IUPAC Name	(7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonic acid
InChI Key	MIOPJNTWMNEORI-UHFFFAOYNA-N
Molecular Formula	C10H16O4S

283

2-Methyl-5-isopropylaniline 93.0+%, TCI America™

CAS: 2051-53-8 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.24 MDL Number: MFCD00044503 InChI Key: YKWALWNGEXPARQ-UHFFFAOYSA-N Synonym: 2-Amino-p-cymene, 5-Isopropyl-2-methylaniline, 5-Isopropyl-o-toluidine PubChem CID: 137414 IUPAC Name: 2-methyl-5-(propan-2-yl)aniline SMILES: CC(C)C1=CC=C(C)C(N)=C1

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Specifications

PubChem CID	137414
CAS	2051-53-8
Molecular Weight (g/mol)	149.24
MDL Number	MFCD00044503
SMILES	CC(C)C1=CC=C(C)C(N)=C1
Synonym	2-Amino-p-cymene, 5-Isopropyl-2-methylaniline, 5-Isopropyl-o-toluidine
IUPAC Name	2-methyl-5-(propan-2-yl)aniline
InChI Key	YKWALWNGEXPARQ-UHFFFAOYSA-N
Molecular Formula	C10H15N

284

1,3-Bis(dicyanomethylidene)indan 98.0+%, TCI America™

CAS: 38172-19-9 Molecular Formula: C15H6N4 Molecular Weight (g/mol): 242.241 MDL Number: MFCD00142514 InChI Key: HBZYYOYCJQHAEL-UHFFFAOYSA-N Synonym: 1,3-Bis(dicyanomethylene)indan PubChem CID: 3360610 IUPAC Name: 2-[3-(dicyanomethylidene)inden-1-ylidene]propanedinitrile SMILES: C1C(=C(C#N)C#N)C2=CC=CC=C2C1=C(C#N)C#N

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Specifications

PubChem CID	3360610
CAS	38172-19-9
Molecular Weight (g/mol)	242.241
MDL Number	MFCD00142514
SMILES	C1C(=C(C#N)C#N)C2=CC=CC=C2C1=C(C#N)C#N
Synonym	1,3-Bis(dicyanomethylene)indan
IUPAC Name	2-[3-(dicyanomethylidene)inden-1-ylidene]propanedinitrile
InChI Key	HBZYYOYCJQHAEL-UHFFFAOYSA-N
Molecular Formula	C15H6N4

285

4-Isopropylbenzyl Alcohol 98.0+%, TCI America™

CAS: 536-60-7 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 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

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Specifications

PubChem CID	325
CAS	536-60-7
Molecular Weight (g/mol)	150.221
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

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