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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226 – 240 of 771 results

226

2,6,6-Trimethyl-2,4-cycloheptadien-1-one 96.0+%, TCI America™

CAS: 503-93-5 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00182537 InChI Key: QNGQIURXCUHNAT-UHFFFAOYSA-N PubChem CID: 136330 ChEBI: CHEBI:80820 IUPAC Name: 2,6,6-trimethylcyclohepta-2,4-dien-1-one SMILES: CC1=CC=CC(CC1=O)(C)C

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Specifications

PubChem CID	136330
CAS	503-93-5
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:80820
MDL Number	MFCD00182537
SMILES	CC1=CC=CC(CC1=O)(C)C
IUPAC Name	2,6,6-trimethylcyclohepta-2,4-dien-1-one
InChI Key	QNGQIURXCUHNAT-UHFFFAOYSA-N
Molecular Formula	C10H14O

227

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

228

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

229

(+)-10-Camphorsulfonimine 97.0+%, TCI America™

CAS: 107869-45-4 Molecular Formula: C10H15NO2S Molecular Weight (g/mol): 213.295 MDL Number: MFCD00013315 InChI Key: ZAHOEBNYVSWBBW-XCBNKYQSSA-N Synonym: (7R)-(+)-10,10-Dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-ene 3,3-Dioxide, (3aR)-(+)-4,5,6,7-Tetrahydro-8,8-dimethyl-3H-3a,6-methano-2,1-benzisothiazole 2,2-Dioxide PubChem CID: 98045278 SMILES: CC1(C2CCC13CS(=O)(=O)N=C3C2)C

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Specifications

PubChem CID	98045278
CAS	107869-45-4
Molecular Weight (g/mol)	213.295
MDL Number	MFCD00013315
SMILES	CC1(C2CCC13CS(=O)(=O)N=C3C2)C
Synonym	(7R)-(+)-10,10-Dimethyl-3-thia-4-azatricyclo[5.2.1.0(1,5)]dec-4-ene 3,3-Dioxide, (3aR)-(+)-4,5,6,7-Tetrahydro-8,8-dimethyl-3H-3a,6-methano-2,1-benzisothiazole 2,2-Dioxide
InChI Key	ZAHOEBNYVSWBBW-XCBNKYQSSA-N
Molecular Formula	C10H15NO2S

230

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

231

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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Specifications

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

232

Terpin Monohydrate 98.0+%, TCI America™

CAS: 2451-01-6 Molecular Formula: C10H22O3 Molecular Weight (g/mol): 190.28 MDL Number: MFCD00149225 InChI Key: JGKJMBOJWVAMIJ-UHFFFAOYSA-N Synonym: terpin hydrate,p-menthane-1,8-diol monohydrate,terpin monohydrate,terpin cis-form hydrate,4-2-hydroxypropan-2-yl-1-methylcyclohexanol hydrate,terpin hydrate usp,terpin hydrate cis-form,cyclohexanemethanol, 4-hydroxy-alpha,alpha,4-trimethyl-, monohydrate PubChem CID: 17141 IUPAC Name: 4-(2-hydroxypropan-2-yl)-1-methylcyclohexan-1-ol;hydrate SMILES: CC1(CCC(CC1)C(C)(C)O)O.O

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Specifications

PubChem CID	17141
CAS	2451-01-6
Molecular Weight (g/mol)	190.28
MDL Number	MFCD00149225
SMILES	CC1(CCC(CC1)C(C)(C)O)O.O
Synonym	terpin hydrate,p-menthane-1,8-diol monohydrate,terpin monohydrate,terpin cis-form hydrate,4-2-hydroxypropan-2-yl-1-methylcyclohexanol hydrate,terpin hydrate usp,terpin hydrate cis-form,cyclohexanemethanol, 4-hydroxy-alpha,alpha,4-trimethyl-, monohydrate
IUPAC Name	4-(2-hydroxypropan-2-yl)-1-methylcyclohexan-1-ol;hydrate
InChI Key	JGKJMBOJWVAMIJ-UHFFFAOYSA-N
Molecular Formula	C10H22O3

233

Geranyl Nitrile 95.0+%, TCI America™

CAS: 5146-66-7 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 MDL Number: MFCD00001926 InChI Key: HLCSDJLATUNSSI-JXMROGBWSA-N Synonym: geranyl nitrile,citralva,3,7-dimethylocta-2,6-dienenitrile,geranonitrile,3,7-dimethyl-2,6-octadienenitrile,e-3,7-dimethyl-2,6-octadienenitrile,unii-w889cv0e9f,2e-3,7-dimethylocta-2,6-dienenitrile,2,6-octadienenitrile, 3,7-dimethyl-, e,2-geranonitrile PubChem CID: 1551246 IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienenitrile SMILES: CC(=CCCC(=CC#N)C)C

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Specifications

PubChem CID	1551246
CAS	5146-66-7
Molecular Weight (g/mol)	149.237
MDL Number	MFCD00001926
SMILES	CC(=CCCC(=CC#N)C)C
Synonym	geranyl nitrile,citralva,3,7-dimethylocta-2,6-dienenitrile,geranonitrile,3,7-dimethyl-2,6-octadienenitrile,e-3,7-dimethyl-2,6-octadienenitrile,unii-w889cv0e9f,2e-3,7-dimethylocta-2,6-dienenitrile,2,6-octadienenitrile, 3,7-dimethyl-, e,2-geranonitrile
IUPAC Name	(2E)-3,7-dimethylocta-2,6-dienenitrile
InChI Key	HLCSDJLATUNSSI-JXMROGBWSA-N
Molecular Formula	C10H15N

234

(+/-)-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

235

(+)-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

236

(-)-Limonene 95.0+%, TCI America™

CAS: 5989-54-8 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.238 MDL Number: MFCD00001558 InChI Key: XMGQYMWWDOXHJM-SNVBAGLBSA-N Synonym: --limonene,l-limonene,s---limonene,s-limonene,--4s-limonene,--s-limonene,s-p-mentha-1,8-diene,unii-47maj1y2ne,4s-limonene,p-mentha-1,8-diene, s-- PubChem CID: 439250 ChEBI: CHEBI:15383 IUPAC Name: (4S)-1-methyl-4-prop-1-en-2-ylcyclohexene SMILES: CC1=CCC(CC1)C(=C)C

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Specifications

PubChem CID	439250
CAS	5989-54-8
Molecular Weight (g/mol)	136.238
ChEBI	CHEBI:15383
MDL Number	MFCD00001558
SMILES	CC1=CCC(CC1)C(=C)C
Synonym	--limonene,l-limonene,s---limonene,s-limonene,--4s-limonene,--s-limonene,s-p-mentha-1,8-diene,unii-47maj1y2ne,4s-limonene,p-mentha-1,8-diene, s--
IUPAC Name	(4S)-1-methyl-4-prop-1-en-2-ylcyclohexene
InChI Key	XMGQYMWWDOXHJM-SNVBAGLBSA-N
Molecular Formula	C10H16

237

(+)-Pulegone 85.0+%, TCI America™

CAS: 89-82-7 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00063000 InChI Key: NZGWDASTMWDZIW-QMMMGPOBSA-N Synonym: --pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one PubChem CID: 638012 ChEBI: CHEBI:81226 IUPAC Name: (5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one SMILES: CC1CCC(=C(C)C)C(=O)C1

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Specifications

PubChem CID	638012
CAS	89-82-7
Molecular Weight (g/mol)	152.237
ChEBI	CHEBI:81226
MDL Number	MFCD00063000
SMILES	CC1CCC(=C(C)C)C(=O)C1
Synonym	--pulegone,s---pulegone,pulegone,-,unii-hl7z89m60h,cyclohexanone, 5-methyl-2-1-methylethylidene-, s,s-p-menth-4 8-en-3-one,s-2-isopropylidene-5-methylcyclohexanone,5s-5-methyl-2-propan-2-ylidenecyclohexan-1-one
IUPAC Name	(5S)-5-methyl-2-propan-2-ylidenecyclohexan-1-one
InChI Key	NZGWDASTMWDZIW-QMMMGPOBSA-N
Molecular Formula	C10H16O

238

Linalyl Propionate 97.0+%, TCI America™

CAS: 144-39-8 Molecular Formula: C13H22O2 Molecular Weight (g/mol): 210.317 MDL Number: MFCD00048607 InChI Key: WAQIIHCCEMGYKP-UHFFFAOYSA-N Synonym: Propionic Acid Linalyl Ester PubChem CID: 61098 IUPAC Name: 3,7-dimethylocta-1,6-dien-3-yl propanoate SMILES: CCC(=O)OC(C)(CCC=C(C)C)C=C

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Specifications

PubChem CID	61098
CAS	144-39-8
Molecular Weight (g/mol)	210.317
MDL Number	MFCD00048607
SMILES	CCC(=O)OC(C)(CCC=C(C)C)C=C
Synonym	Propionic Acid Linalyl Ester
IUPAC Name	3,7-dimethylocta-1,6-dien-3-yl propanoate
InChI Key	WAQIIHCCEMGYKP-UHFFFAOYSA-N
Molecular Formula	C13H22O2

239

(-)-Terpinen-4-ol 95.0+%, TCI America™

CAS: 20126-76-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.253 MDL Number: MFCD00167108 InChI Key: WRYLYDPHFGVWKC-JTQLQIEISA-N Synonym: --terpinen-4-ol,--4-terpineol,unii-8vi196vs5t,p-menth-1-en-4-ol, r--,r-p-menth-1-en-4-ol,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, r,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, 1r,r-1-isopropyl-4-methyl-3-cyclohexen-1-ol,l-4-terpineneol,l-4-terpineol PubChem CID: 5325830 IUPAC Name: (1R)-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	5325830
CAS	20126-76-5
Molecular Weight (g/mol)	154.253
MDL Number	MFCD00167108
SMILES	CC1=CCC(CC1)(C(C)C)O
Synonym	--terpinen-4-ol,--4-terpineol,unii-8vi196vs5t,p-menth-1-en-4-ol, r--,r-p-menth-1-en-4-ol,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, r,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, 1r,r-1-isopropyl-4-methyl-3-cyclohexen-1-ol,l-4-terpineneol,l-4-terpineol
IUPAC Name	(1R)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol
InChI Key	WRYLYDPHFGVWKC-JTQLQIEISA-N
Molecular Formula	C10H18O

240

NEO-823 98.0+%, TCI America™

CAS: 1267603-73-5 Molecular Formula: C44H39F3N4O2S Molecular Weight (g/mol): 744.877 InChI Key: SXFGKYGUYHUANQ-NRJODPMSSA-N Synonym: 2-[4-[2-[5-[2-(Benzyloxy)-4-(dibutylamino)styryl]thiophen-2-yl]vinyl]-3-cyano-5-phenyl-5-(trifluoromethyl)furan-2(5H)-ylidene]malononitrile, 2-[3-Cyano-4-[2-[5-[2-[4-(dibutylamino)-2-(phenylmethoxy)phenyl]ethenyl]-2-thienyl]ethenyl]-5-phenyl-5-(trifluorom PubChem CID: 88549116 IUPAC Name: 2-[3-cyano-4-[(E)-2-[5-[(E)-2-[4-(dibutylamino)-2-phenylmethoxyphenyl]ethenyl]thiophen-2-yl]ethenyl]-5-phenyl-5-(trifluoromethyl)furan-2-ylidene]propanedinitrile SMILES: CCCCN(CCCC)C1=CC(=C(C=C1)C=CC2=CC=C(S2)C=CC3=C(C(=C(C#N)C#N)OC3(C4=CC=CC=C4)C(F)(F)F)C#N)OCC5=CC=CC=C5

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Specifications

PubChem CID	88549116
CAS	1267603-73-5
Molecular Weight (g/mol)	744.877
SMILES	CCCCN(CCCC)C1=CC(=C(C=C1)C=CC2=CC=C(S2)C=CC3=C(C(=C(C#N)C#N)OC3(C4=CC=CC=C4)C(F)(F)F)C#N)OCC5=CC=CC=C5
Synonym	2-[4-[2-[5-[2-(Benzyloxy)-4-(dibutylamino)styryl]thiophen-2-yl]vinyl]-3-cyano-5-phenyl-5-(trifluoromethyl)furan-2(5H)-ylidene]malononitrile, 2-[3-Cyano-4-[2-[5-[2-[4-(dibutylamino)-2-(phenylmethoxy)phenyl]ethenyl]-2-thienyl]ethenyl]-5-phenyl-5-(trifluorom
IUPAC Name	2-[3-cyano-4-[(E)-2-[5-[(E)-2-[4-(dibutylamino)-2-phenylmethoxyphenyl]ethenyl]thiophen-2-yl]ethenyl]-5-phenyl-5-(trifluoromethyl)furan-2-ylidene]propanedinitrile
InChI Key	SXFGKYGUYHUANQ-NRJODPMSSA-N
Molecular Formula	C44H39F3N4O2S

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