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 791 results

271

(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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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

272

1,4-Diisopropylbenzene 98.0+%, TCI America™

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 IUPAC Name: 1,4-bis(propan-2-yl)benzene SMILES: CC(C)C1=CC=C(C=C1)C(C)C

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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
IUPAC Name	1,4-bis(propan-2-yl)benzene
InChI Key	SPPWGCYEYAMHDT-UHFFFAOYSA-N
Molecular Formula	C12H18

273

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

CAS: 62067-45-2 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.252 MDL Number: MFCD01734696 InChI Key: YRQKWRUZZCBSIG-UHFFFAOYSA-N PubChem CID: 81526 IUPAC Name: 4-propan-2-ylcyclohexane-1-carboxylic acid SMILES: CC(C)C1CCC(CC1)C(=O)O

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Specifications

PubChem CID	81526
CAS	62067-45-2
Molecular Weight (g/mol)	170.252
MDL Number	MFCD01734696
SMILES	CC(C)C1CCC(CC1)C(=O)O
IUPAC Name	4-propan-2-ylcyclohexane-1-carboxylic acid
InChI Key	YRQKWRUZZCBSIG-UHFFFAOYSA-N
Molecular Formula	C10H18O2

274

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

275

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

276

Bis[(2R,3aS,4R,7aS)-octahydro-7,8,8-trimethyl-4,7-methanobenzofuran-2-yl] Ether 98.0+%, TCI America™

CAS: 87248-50-8 Molecular Formula: C24H38O3 Molecular Weight (g/mol): 374.565 MDL Number: MFCD00074783 InChI Key: VUDXCBLBKXFCNA-VFQSMPPFSA-N Synonym: (+)-MBF-OH Dimer, (+)-Noe′Cs Reagent PubChem CID: 12916568 SMILES: CC1(C2CCC1(C3C2CC(O3)OC4CC5C6CCC(C5O4)(C6(C)C)C)C)C

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Specifications

PubChem CID	12916568
CAS	87248-50-8
Molecular Weight (g/mol)	374.565
MDL Number	MFCD00074783
SMILES	CC1(C2CCC1(C3C2CC(O3)OC4CC5C6CCC(C5O4)(C6(C)C)C)C)C
Synonym	(+)-MBF-OH Dimer, (+)-Noe′Cs Reagent
InChI Key	VUDXCBLBKXFCNA-VFQSMPPFSA-N
Molecular Formula	C24H38O3

277

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

278

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

279

(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

280

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

281

(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

282

(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-

283

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

284

(+)-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

285

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

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