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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166 – 180 of 794 results

166

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p-Cymene, 97%

CAS: 99-87-6 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00008893 InChI Key: HFPZCAJZSCWRBC-UHFFFAOYSA-N Synonym: p-cymene,4-isopropyltoluene,p-isopropyltoluene,dolcymene,p-cymol,paracymene,cymene,para-cymene,1-isopropyl-4-methylbenzene,camphogen PubChem CID: 7463 ChEBI: CHEBI:28768 IUPAC Name: 1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C

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Specifications

PubChem CID	7463
CAS	99-87-6
Molecular Weight (g/mol)	134.222
ChEBI	CHEBI:28768
MDL Number	MFCD00008893
SMILES	CC1=CC=C(C=C1)C(C)C
Synonym	p-cymene,4-isopropyltoluene,p-isopropyltoluene,dolcymene,p-cymol,paracymene,cymene,para-cymene,1-isopropyl-4-methylbenzene,camphogen
IUPAC Name	1-methyl-4-propan-2-ylbenzene
InChI Key	HFPZCAJZSCWRBC-UHFFFAOYSA-N
Molecular Formula	C10H14

167

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4,4'-Diisopropylbiphenyl, 97%

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 SMILES: CC(C)C1=CC=C(C=C1)C1=CC=C(C=C1)C(C)C

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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
InChI Key	NUEUMFZLNOCRCQ-UHFFFAOYSA-N
Molecular Formula	C18H22

168

(+/-)-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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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

169

Thymol 99.0+%, TCI America™

CAS: 89-83-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002309 InChI Key: MGSRCZKZVOBKFT-UHFFFAOYSA-N Synonym: thymol,2-isopropyl-5-methylphenol,5-methyl-2-isopropylphenol,thyme camphor,3-p-cymenol,6-isopropyl-m-cresol,thymic acid,isopropyl cresol,5-methyl-2-1-methylethyl phenol,6-isopropyl-3-methylphenol PubChem CID: 6989 ChEBI: CHEBI:27607 IUPAC Name: 5-methyl-2-propan-2-ylphenol SMILES: CC1=CC(=C(C=C1)C(C)C)O

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Specifications

PubChem CID	6989
CAS	89-83-8
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:27607
MDL Number	MFCD00002309
SMILES	CC1=CC(=C(C=C1)C(C)C)O
Synonym	thymol,2-isopropyl-5-methylphenol,5-methyl-2-isopropylphenol,thyme camphor,3-p-cymenol,6-isopropyl-m-cresol,thymic acid,isopropyl cresol,5-methyl-2-1-methylethyl phenol,6-isopropyl-3-methylphenol
IUPAC Name	5-methyl-2-propan-2-ylphenol
InChI Key	MGSRCZKZVOBKFT-UHFFFAOYSA-N
Molecular Formula	C10H14O

170

Citral Dimethyl Acetal (cis- and trans- mixture) 90.0+%, TCI America™

CAS: 7549-37-3 Molecular Formula: C12H22O2 Molecular Weight (g/mol): 198.306 MDL Number: MFCD00008909 InChI Key: ZSKAJFSSXURRGL-PKNBQFBNSA-N Synonym: 1,1-Dimethoxy-3,7-dimethyl-2,6-octadiene PubChem CID: 5352435 IUPAC Name: (2E)-1,1-dimethoxy-3,7-dimethylocta-2,6-diene SMILES: CC(=CCCC(=CC(OC)OC)C)C

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Specifications

PubChem CID	5352435
CAS	7549-37-3
Molecular Weight (g/mol)	198.306
MDL Number	MFCD00008909
SMILES	CC(=CCCC(=CC(OC)OC)C)C
Synonym	1,1-Dimethoxy-3,7-dimethyl-2,6-octadiene
IUPAC Name	(2E)-1,1-dimethoxy-3,7-dimethylocta-2,6-diene
InChI Key	ZSKAJFSSXURRGL-PKNBQFBNSA-N
Molecular Formula	C12H22O2

171

(1S,2S,3R,5S)-(+)-2,3-Pinanediol 98.0+%, TCI America™

CAS: 18680-27-8 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.252 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

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Specifications

PubChem CID	10219606
CAS	18680-27-8
Molecular Weight (g/mol)	170.252
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

172

(1S)-(-)-alpha-Pinene 97.0+%, TCI America™

CAS: 7785-26-4 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.238 MDL Number: MFCD00064145 InChI Key: GRWFGVWFFZKLTI-IUCAKERBSA-N Synonym: --alpha-pinene,1s,5s-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1s---alpha-pinene,unii-tzr3gm95pr,dl-alpha-pinene,alpha-pinene,-,1s,5s-alpha-pinene,tzr3gm95pr,1s,5s-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1s,5s PubChem CID: 440968 ChEBI: CHEBI:28660 IUPAC Name: (1S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-ene SMILES: CC1=CCC2CC1C2(C)C

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Specifications

PubChem CID	440968
CAS	7785-26-4
Molecular Weight (g/mol)	136.238
ChEBI	CHEBI:28660
MDL Number	MFCD00064145
SMILES	CC1=CCC2CC1C2(C)C
Synonym	--alpha-pinene,1s,5s-2,6,6-trimethylbicyclo 3.1.1 hept-2-ene,1s---alpha-pinene,unii-tzr3gm95pr,dl-alpha-pinene,alpha-pinene,-,1s,5s-alpha-pinene,tzr3gm95pr,1s,5s-2-pinene,bicyclo 3.1.1 hept-2-ene, 2,6,6-trimethyl-, 1s,5s
IUPAC Name	(1S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-ene
InChI Key	GRWFGVWFFZKLTI-IUCAKERBSA-N
Molecular Formula	C10H16

173

(-)-Menthyl Succinate 98.0+%, TCI America™

CAS: 77341-67-4 Molecular Formula: C14H24O4 Molecular Weight (g/mol): 256.342 MDL Number: MFCD23135646 InChI Key: BLILOGGUTRWFNI-GRYCIOLGSA-N Synonym: Succinic Acid (-)-Menthyl Ester, (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Succinate, Succinic Acid (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Ester PubChem CID: 11219061 IUPAC Name: 4-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-4-oxobutanoic acid SMILES: CC1CCC(C(C1)OC(=O)CCC(=O)O)C(C)C

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Specifications

PubChem CID	11219061
CAS	77341-67-4
Molecular Weight (g/mol)	256.342
MDL Number	MFCD23135646
SMILES	CC1CCC(C(C1)OC(=O)CCC(=O)O)C(C)C
Synonym	Succinic Acid (-)-Menthyl Ester, (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Succinate, Succinic Acid (1R,2S,5R)-2-Isopropyl-5-methylcyclohexyl Ester
IUPAC Name	4-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-4-oxobutanoic acid
InChI Key	BLILOGGUTRWFNI-GRYCIOLGSA-N
Molecular Formula	C14H24O4

174

(+/-)-Camphene (contains ca. 20% Tricyclene) 78.0+%, TCI America™

CAS: 79-92-5 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.238 MDL Number: MFCD00066603 InChI Key: CRPUJAZIXJMDBK-UHFFFAOYSA-N Synonym: camphene,comphene,2,2-dimethyl-3-methylenenorbornane,3,3-dimethyl-2-methylenenorbornane,3,3-dimethyl-2-methylenenorcamphane,+/--camphene,2,2-dimethyl-3-methylenebicyclo 2.2.1 heptane,2,2-dimethyl-3-methylidenebicyclo 2.2.1 heptane,bicyclo 2.2.1 heptane, 2,2-dimethyl-3-methylene,fema no. 2229 PubChem CID: 6616 ChEBI: CHEBI:3830 IUPAC Name: 3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane SMILES: CC1(C2CCC(C2)C1=C)C

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Specifications

PubChem CID	6616
CAS	79-92-5
Molecular Weight (g/mol)	136.238
ChEBI	CHEBI:3830
MDL Number	MFCD00066603
SMILES	CC1(C2CCC(C2)C1=C)C
Synonym	camphene,comphene,2,2-dimethyl-3-methylenenorbornane,3,3-dimethyl-2-methylenenorbornane,3,3-dimethyl-2-methylenenorcamphane,+/--camphene,2,2-dimethyl-3-methylenebicyclo 2.2.1 heptane,2,2-dimethyl-3-methylidenebicyclo 2.2.1 heptane,bicyclo 2.2.1 heptane, 2,2-dimethyl-3-methylene,fema no. 2229
IUPAC Name	3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptane
InChI Key	CRPUJAZIXJMDBK-UHFFFAOYSA-N
Molecular Formula	C10H16

175

Isobornyl Methacrylate (stabilized with MEHQ) 85.0+%, TCI America™

CAS: 7534-94-3 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00081070 InChI Key: IAXXETNIOYFMLW-UHFFFAOYNA-N Synonym: ibma,isobornyl methacrylate,methacrylic acid isobornyl ester,iso-bornyl methacrylate,isobornyl methacrylate, technical grade,isobornyl methacrylate, stabilized with mehq,exo-1,7,7-trimethylbicyclo 2.2.1 hept-,2-yl methacrylate,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl 2-methylprop-2-enoate PubChem CID: 71311141 IUPAC Name: 1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 2-methylprop-2-enoate SMILES: CC(=C)C(=O)OC1CC2CCC1(C)C2(C)C

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Specifications

PubChem CID	71311141
CAS	7534-94-3
Molecular Weight (g/mol)	222.33
MDL Number	MFCD00081070
SMILES	CC(=C)C(=O)OC1CC2CCC1(C)C2(C)C
Synonym	ibma,isobornyl methacrylate,methacrylic acid isobornyl ester,iso-bornyl methacrylate,isobornyl methacrylate, technical grade,isobornyl methacrylate, stabilized with mehq,exo-1,7,7-trimethylbicyclo 2.2.1 hept-,2-yl methacrylate,1r,4r-1,7,7-trimethylbicyclo 2.2.1 heptan-2-yl 2-methylprop-2-enoate
IUPAC Name	1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 2-methylprop-2-enoate
InChI Key	IAXXETNIOYFMLW-UHFFFAOYNA-N
Molecular Formula	C14H22O2

176

(-)-beta-Pinene 94.0+%, TCI America™

CAS: 18172-67-3 Molecular Formula: C10H16 Molecular Weight (g/mol): 136.238 MDL Number: MFCD00063635 InChI Key: WTARULDDTDQWMU-IUCAKERBSA-N Synonym: --beta-pinene,--nopinene,1s,5s-6,6-dimethyl-2-methylenebicyclo 3.1.1 heptane,1s---beta-pinene,--b-pinene,--pin-2 10-ene,unii-afn153a7su,--?-pinene,1s-1-beta-pinene,afn153a7su PubChem CID: 440967 ChEBI: CHEBI:28359 IUPAC Name: (1S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane SMILES: CC1(C2CCC(=C)C1C2)C

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Specifications

PubChem CID	440967
CAS	18172-67-3
Molecular Weight (g/mol)	136.238
ChEBI	CHEBI:28359
MDL Number	MFCD00063635
SMILES	CC1(C2CCC(=C)C1C2)C
Synonym	--beta-pinene,--nopinene,1s,5s-6,6-dimethyl-2-methylenebicyclo 3.1.1 heptane,1s---beta-pinene,--b-pinene,--pin-2 10-ene,unii-afn153a7su,--?-pinene,1s-1-beta-pinene,afn153a7su
IUPAC Name	(1S,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptane
InChI Key	WTARULDDTDQWMU-IUCAKERBSA-N
Molecular Formula	C10H16

177

3-(4-Isopropylphenyl)isobutyraldehyde 92.0+%, TCI America™

CAS: 103-95-7 Molecular Formula: C13H18O Molecular Weight (g/mol): 190.29 MDL Number: MFCD00024160 InChI Key: HQQPOVNESMNPNH-UHFFFAOYNA-N Synonym: 4-Isopropyl-alpha-methylhydrocinnamaldehyde PubChem CID: 517827 IUPAC Name: 3-[4-(propan-2-yl)phenyl]butanal SMILES: CC(C)C1=CC=C(C=C1)C(C)CC=O

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Specifications

PubChem CID	517827
CAS	103-95-7
Molecular Weight (g/mol)	190.29
MDL Number	MFCD00024160
SMILES	CC(C)C1=CC=C(C=C1)C(C)CC=O
Synonym	4-Isopropyl-alpha-methylhydrocinnamaldehyde
IUPAC Name	3-[4-(propan-2-yl)phenyl]butanal
InChI Key	HQQPOVNESMNPNH-UHFFFAOYNA-N
Molecular Formula	C13H18O

178

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

179

(+)-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

180

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

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