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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241 – 255 of 771 results

241

(+)-Neomenthol 96.0+%, TCI America™

CAS: 2216-52-6 Molecular Formula: C10H20O Molecular Weight (g/mol): 156.269 MDL Number: MFCD00062980 InChI Key: NOOLISFMXDJSKH-UTLUCORTSA-N Synonym: (1S,2S,5R)-2-Isopropyl-5-methylcyclohexanol PubChem CID: 439263 ChEBI: CHEBI:15402 IUPAC Name: (1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol SMILES: CC1CCC(C(C1)O)C(C)C

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Specifications

PubChem CID	439263
CAS	2216-52-6
Molecular Weight (g/mol)	156.269
ChEBI	CHEBI:15402
MDL Number	MFCD00062980
SMILES	CC1CCC(C(C1)O)C(C)C
Synonym	(1S,2S,5R)-2-Isopropyl-5-methylcyclohexanol
IUPAC Name	(1S,2S,5R)-5-methyl-2-propan-2-ylcyclohexan-1-ol
InChI Key	NOOLISFMXDJSKH-UTLUCORTSA-N
Molecular Formula	C10H20O

242

4-Isopropylbenzoic Acid 98.0+%, TCI America™

CAS: 536-66-3 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002564 InChI Key: CKMXAIVXVKGGFM-UHFFFAOYSA-N Synonym: 4-isopropylbenzoic acid,cuminic acid,cumic acid,p-isopropylbenzoic acid,4-1-methylethyl benzoic acid,benzoic acid, 4-1-methylethyl,4-propan-2-yl benzoic acid,benzoic acid, p-isopropyl,p-cumic acid,4-isopropyl benzoic acid PubChem CID: 10820 ChEBI: CHEBI:28122 IUPAC Name: 4-propan-2-ylbenzoic acid SMILES: CC(C)C1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	10820
CAS	536-66-3
Molecular Weight (g/mol)	164.204
ChEBI	CHEBI:28122
MDL Number	MFCD00002564
SMILES	CC(C)C1=CC=C(C=C1)C(=O)O
Synonym	4-isopropylbenzoic acid,cuminic acid,cumic acid,p-isopropylbenzoic acid,4-1-methylethyl benzoic acid,benzoic acid, 4-1-methylethyl,4-propan-2-yl benzoic acid,benzoic acid, p-isopropyl,p-cumic acid,4-isopropyl benzoic acid
IUPAC Name	4-propan-2-ylbenzoic acid
InChI Key	CKMXAIVXVKGGFM-UHFFFAOYSA-N
Molecular Formula	C10H12O2

243

2-Isopropyl-5-methylanisole 96.0+%, TCI America™

CAS: 1076-56-8 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 MDL Number: MFCD01674973 InChI Key: LSQXNMXDFRRDSJ-UHFFFAOYSA-N Synonym: 1-Isopropyl-2-methoxy-4-methylbenzene, 4-Isopropyl-3-methoxytoluene PubChem CID: 14104 IUPAC Name: 2-methoxy-4-methyl-1-propan-2-ylbenzene SMILES: CC1=CC(=C(C=C1)C(C)C)OC

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Specifications

PubChem CID	14104
CAS	1076-56-8
Molecular Weight (g/mol)	164.248
MDL Number	MFCD01674973
SMILES	CC1=CC(=C(C=C1)C(C)C)OC
Synonym	1-Isopropyl-2-methoxy-4-methylbenzene, 4-Isopropyl-3-methoxytoluene
IUPAC Name	2-methoxy-4-methyl-1-propan-2-ylbenzene
InChI Key	LSQXNMXDFRRDSJ-UHFFFAOYSA-N
Molecular Formula	C11H16O

244

4,4'-Diisopropylbiphenyl, TCI America™

CAS: 18970-30-4 Molecular Formula: C18H22 Molecular Weight (g/mol): 238.37 MDL Number: MFCD00043533 InChI Key: NUEUMFZLNOCRCQ-UHFFFAOYSA-N Synonym: 4,4'-diisopropylbiphenyl,4,4'-diisopropyl-1,1'-biphenyl,4,4'-di-iso-propylbiphenyl,unii-wr8g413l6a,1,1'-biphenyl, 4,4'-bis 1-methylethyl,4,4-diisopropylbiphenyl,1,1'-biphenyl, 4,4'-bis-1-methylethyl,1-propan-2-yl-4-4-propan-2-ylphenyl benzene,biphenyl, 4,4'-diisopropyl,pubchem17483 PubChem CID: 519615 IUPAC Name: 4,4'-bis(propan-2-yl)-1,1'-biphenyl SMILES: CC(C)C1=CC=C(C=C1)C1=CC=C(C=C1)C(C)C

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Specifications

PubChem CID	519615
CAS	18970-30-4
Molecular Weight (g/mol)	238.37
MDL Number	MFCD00043533
SMILES	CC(C)C1=CC=C(C=C1)C1=CC=C(C=C1)C(C)C
Synonym	4,4'-diisopropylbiphenyl,4,4'-diisopropyl-1,1'-biphenyl,4,4'-di-iso-propylbiphenyl,unii-wr8g413l6a,1,1'-biphenyl, 4,4'-bis 1-methylethyl,4,4-diisopropylbiphenyl,1,1'-biphenyl, 4,4'-bis-1-methylethyl,1-propan-2-yl-4-4-propan-2-ylphenyl benzene,biphenyl, 4,4'-diisopropyl,pubchem17483
IUPAC Name	4,4'-bis(propan-2-yl)-1,1'-biphenyl
InChI Key	NUEUMFZLNOCRCQ-UHFFFAOYSA-N
Molecular Formula	C18H22

245

Carvacrol 98.0+%, TCI America™

CAS: 499-75-2 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00002236 InChI Key: RECUKUPTGUEGMW-UHFFFAOYSA-N Synonym: carvacrol,5-isopropyl-2-methylphenol,isopropyl-o-cresol,o-thymol,antioxine,isothymol,karvakrol,5-isopropyl-o-cresol,2-p-cymenol,2-hydroxy-p-cymene PubChem CID: 10364 ChEBI: CHEBI:3440 IUPAC Name: 2-methyl-5-(propan-2-yl)phenol SMILES: CC(C)C1=CC=C(C)C(O)=C1

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Specifications

PubChem CID	10364
CAS	499-75-2
Molecular Weight (g/mol)	150.22
ChEBI	CHEBI:3440
MDL Number	MFCD00002236
SMILES	CC(C)C1=CC=C(C)C(O)=C1
Synonym	carvacrol,5-isopropyl-2-methylphenol,isopropyl-o-cresol,o-thymol,antioxine,isothymol,karvakrol,5-isopropyl-o-cresol,2-p-cymenol,2-hydroxy-p-cymene
IUPAC Name	2-methyl-5-(propan-2-yl)phenol
InChI Key	RECUKUPTGUEGMW-UHFFFAOYSA-N
Molecular Formula	C10H14O

246

N-(2-Carboxybenzoyl)-(-)-10,2-camphorsultam 98.0+%, TCI America™

CAS: 179950-32-4 Molecular Formula: C18H21NO5S Molecular Weight (g/mol): 363.43 MDL Number: MFCD04117913 InChI Key: UJCSAJNSMWSFHF-UHFFFAOYNA-N

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Specifications

CAS	179950-32-4
Molecular Weight (g/mol)	363.43
MDL Number	MFCD04117913
InChI Key	UJCSAJNSMWSFHF-UHFFFAOYNA-N
Molecular Formula	C18H21NO5S

247

Flurbiprofen 98.0+%, TCI America™

CAS: 5104-49-4 Molecular Formula: C15H13FO2 Molecular Weight (g/mol): 244.27 MDL Number: MFCD00079303 InChI Key: SYTBZMRGLBWNTM-UHFFFAOYNA-N Synonym: flurbiprofen,ansaid,froben,antadys,cebutid,flurofen,anside,flurbiprofene,flurbiprofeno,flurbiprofenum PubChem CID: 3394 ChEBI: CHEBI:5130 IUPAC Name: 2-{2-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid SMILES: CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1

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Specifications

PubChem CID	3394
CAS	5104-49-4
Molecular Weight (g/mol)	244.27
ChEBI	CHEBI:5130
MDL Number	MFCD00079303
SMILES	CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1
Synonym	flurbiprofen,ansaid,froben,antadys,cebutid,flurofen,anside,flurbiprofene,flurbiprofeno,flurbiprofenum
IUPAC Name	2-{2-fluoro-[1,1'-biphenyl]-4-yl}propanoic acid
InChI Key	SYTBZMRGLBWNTM-UHFFFAOYNA-N
Molecular Formula	C15H13FO2

248

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

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

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Specifications

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

249

Piperitone (mixture of enantiomers, predominantly (R)-(-)-form) 94.0+%, TCI America™

CAS: 89-81-6 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 InChI Key: YSTPAHQEHQSRJD-UHFFFAOYSA-N Synonym: p-Menth-1-en-3-one, 6-Isopropyl-3-methyl-2-cyclohexen-1-one PubChem CID: 6987 ChEBI: CHEBI:48933 IUPAC Name: 3-methyl-6-propan-2-ylcyclohex-2-en-1-one SMILES: CC1=CC(=O)C(CC1)C(C)C

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Specifications

PubChem CID	6987
CAS	89-81-6
Molecular Weight (g/mol)	152.237
ChEBI	CHEBI:48933
SMILES	CC1=CC(=O)C(CC1)C(C)C
Synonym	p-Menth-1-en-3-one, 6-Isopropyl-3-methyl-2-cyclohexen-1-one
IUPAC Name	3-methyl-6-propan-2-ylcyclohex-2-en-1-one
InChI Key	YSTPAHQEHQSRJD-UHFFFAOYSA-N
Molecular Formula	C10H16O

250

Isopulegol (mixture of isomers) 90.0+%, TCI America™

CAS: 7786-67-6 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00134655 InChI Key: ZYTMANIQRDEHIO-UHFFFAOYNA-N Synonym: p-menth-8-en-3-ol,isopulegol,8 9-p-menthen-3-ol,5-methyl-2-prop-1-en-2-yl cyclohexanol,cyclohexanol, 5-methyl-2-1-methylethenyl,1-methyl-4-isopropenylcyclohexan-3-ol,dl-isopulegol,p-8 9-menthen-3-ol,5-methyl-2-1-methylvinyl cyclohexan-1-ol,5-methyl-2-prop-1-en-2-yl cyclohexan-1-ol PubChem CID: 24585 IUPAC Name: 5-methyl-2-(prop-1-en-2-yl)cyclohexan-1-ol SMILES: CC1CCC(C(O)C1)C(C)=C

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Specifications

PubChem CID	24585
CAS	7786-67-6
Molecular Weight (g/mol)	154.25
MDL Number	MFCD00134655
SMILES	CC1CCC(C(O)C1)C(C)=C
Synonym	p-menth-8-en-3-ol,isopulegol,8 9-p-menthen-3-ol,5-methyl-2-prop-1-en-2-yl cyclohexanol,cyclohexanol, 5-methyl-2-1-methylethenyl,1-methyl-4-isopropenylcyclohexan-3-ol,dl-isopulegol,p-8 9-menthen-3-ol,5-methyl-2-1-methylvinyl cyclohexan-1-ol,5-methyl-2-prop-1-en-2-yl cyclohexan-1-ol
IUPAC Name	5-methyl-2-(prop-1-en-2-yl)cyclohexan-1-ol
InChI Key	ZYTMANIQRDEHIO-UHFFFAOYNA-N
Molecular Formula	C10H18O

251

(R,R)-(-)-N,N'-Bis(3,5-di-tert-butylsalicylidene)-1,2-cyclohexanediaminomanganese(III) Chloride 98.0+%, TCI America™

CAS: 138124-32-0 Molecular Formula: C36H54ClMnN2O2- Molecular Weight (g/mol): 637.228 MDL Number: MFCD02101664 InChI Key: YRVXCOIDMFNGIJ-SEILFYAJSA-M Synonym: 1r,2r---1,2-cyclohexanediamino-n,n'-bis 3,5-di-t-butylsalicylidene manganese iii chloride r,r-jacobsen cat. PubChem CID: 131675872 IUPAC Name: 2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one;manganese;chloride SMILES: CC(C)(C)C1=CC(=CNC2CCCCC2NC=C3C=C(C=C(C3=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C.[Cl-].[Mn]

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Specifications

PubChem CID	131675872
CAS	138124-32-0
Molecular Weight (g/mol)	637.228
MDL Number	MFCD02101664
SMILES	CC(C)(C)C1=CC(=CNC2CCCCC2NC=C3C=C(C=C(C3=O)C(C)(C)C)C(C)(C)C)C(=O)C(=C1)C(C)(C)C.[Cl-].[Mn]
Synonym	1r,2r---1,2-cyclohexanediamino-n,n'-bis 3,5-di-t-butylsalicylidene manganese iii chloride r,r-jacobsen cat.
IUPAC Name	2,4-ditert-butyl-6-[[[(1R,2R)-2-[(3,5-ditert-butyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]cyclohexyl]amino]methylidene]cyclohexa-2,4-dien-1-one;manganese;chloride
InChI Key	YRVXCOIDMFNGIJ-SEILFYAJSA-M
Molecular Formula	C36H54ClMnN2O2-

252

(+)-B-Chlorodiisopinocampheylborane (58% in Hexane, ca. 1.6mol/L), TCI America™

CAS: 112246-73-8 Molecular Formula: C20H34BCl Molecular Weight (g/mol): 320.75 MDL Number: MFCD00074808 InChI Key: PSEHHVRCDVOTID-NAVXHOJHSA-N Synonym: +-b-chlorodiisopinocamphenylborane PubChem CID: 133124869 IUPAC Name: chlorobis[(1S,2R,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl]borane SMILES: C[C@H]1[C@@H]2C[C@H](C[C@@H]1B(Cl)[C@H]1C[C@H]3C[C@@H]([C@@H]1C)C3(C)C)C2(C)C

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Specifications

PubChem CID	133124869
CAS	112246-73-8
Molecular Weight (g/mol)	320.75
MDL Number	MFCD00074808
SMILES	C[C@H]1[C@@H]2C[C@H](C[C@@H]1B(Cl)[C@H]1C[C@H]3C[C@@H]([C@@H]1C)C3(C)C)C2(C)C
Synonym	+-b-chlorodiisopinocamphenylborane
IUPAC Name	chlorobis[(1S,2R,3S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl]borane
InChI Key	PSEHHVRCDVOTID-NAVXHOJHSA-N
Molecular Formula	C20H34BCl

253

(+)-Camphor 98.0+%, TCI America™

CAS: 464-49-3 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00064149,MFCD00074738,MFCD00064149,MFCD00064149 InChI Key: DSSYKIVIOFKYAU-XVKPBYJWSA-N Synonym: +-camphor,d-camphor,1r-+-camphor,r-camphor,+-bornan-2-one,r-+-camphor,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-one,1r,4r-camphor,camphor d,+-2-bornanone PubChem CID: 159055 ChEBI: CHEBI:15396 IUPAC Name: (1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one SMILES: CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2

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Specifications

PubChem CID	159055
CAS	464-49-3
Molecular Weight (g/mol)	152.24
ChEBI	CHEBI:15396
MDL Number	MFCD00064149,MFCD00074738,MFCD00064149,MFCD00064149
SMILES	CC1(C)[C@H]2CC[C@@]1(C)C(=O)C2
Synonym	+-camphor,d-camphor,1r-+-camphor,r-camphor,+-bornan-2-one,r-+-camphor,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-one,1r,4r-camphor,camphor d,+-2-bornanone
IUPAC Name	(1R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
InChI Key	DSSYKIVIOFKYAU-XVKPBYJWSA-N
Molecular Formula	C10H16O

254

Thymolphthalein (0.1% in ca. 95% Ethanol) [for pH Determination and Titration], TCI America™

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

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Specifications

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

255

(S)-(+)-Carvone 98.0+%, TCI America™

CAS: 2244-16-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 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

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Specifications

PubChem CID	16724
CAS	2244-16-8
Molecular Weight (g/mol)	150.221
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

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