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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286 – 300 of 775 results

286

(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]

Pricing & Availability
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-

287

(-)-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

Pricing & Availability
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

288

(+)-10-Camphorsulfonyl Chloride 97.0+%, TCI America™

CAS: 21286-54-4 Molecular Formula: C10H15ClO3S Molecular Weight (g/mol): 250.737 MDL Number: MFCD00064156 InChI Key: BGABKEVTHIJBIW-GMSGAONNSA-N Synonym: d +-10-camphorsulfonyl chloride,1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonyl chloride,1s-+-camphor-10-sulfonyl chloride,d-2-oxobornane-10-sulphonyl chloride,1s-+-10-camphorsulfonyl chloride,d-+-10-camphorsulfonyl chloride,camphor-10-sulfonyl chloride,+-camphor-10-sulfonyl chloride,+-camphor-10-sulfonic acid chloride PubChem CID: 88856 IUPAC Name: [(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonyl chloride SMILES: CC1(C2CCC1(C(=O)C2)CS(=O)(=O)Cl)C

Pricing & Availability
Specifications

PubChem CID	88856
CAS	21286-54-4
Molecular Weight (g/mol)	250.737
MDL Number	MFCD00064156
SMILES	CC1(C2CCC1(C(=O)C2)CS(=O)(=O)Cl)C
Synonym	d +-10-camphorsulfonyl chloride,1s,4r-7,7-dimethyl-2-oxobicyclo 2.2.1 heptan-1-yl methanesulfonyl chloride,1s-+-camphor-10-sulfonyl chloride,d-2-oxobornane-10-sulphonyl chloride,1s-+-10-camphorsulfonyl chloride,d-+-10-camphorsulfonyl chloride,camphor-10-sulfonyl chloride,+-camphor-10-sulfonyl chloride,+-camphor-10-sulfonic acid chloride
IUPAC Name	[(1R,4S)-7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonyl chloride
InChI Key	BGABKEVTHIJBIW-GMSGAONNSA-N
Molecular Formula	C10H15ClO3S

289

(1R,2S,5R)-(-)-Menthyl (S)-p-Toluenesulfinate 98.0+%, TCI America™

CAS: 1517-82-4 Molecular Formula: C17H26O2S Molecular Weight (g/mol): 294.453 MDL Number: MFCD00010192 InChI Key: NQICGNSARVCSGJ-DSRNLFJRSA-N Synonym: 1r,2s,5r---menthyl s-p-toluenesulfinate,4-methylbenzenesulfinic acid 1r,5r-2-isopropyl-5-methylcyclohexyl ester PubChem CID: 101348873 IUPAC Name: [(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl] 4-methylbenzenesulfinate SMILES: CC1CCC(C(C1)OS(=O)C2=CC=C(C=C2)C)C(C)C

Pricing & Availability
Specifications

PubChem CID	101348873
CAS	1517-82-4
Molecular Weight (g/mol)	294.453
MDL Number	MFCD00010192
SMILES	CC1CCC(C(C1)OS(=O)C2=CC=C(C=C2)C)C(C)C
Synonym	1r,2s,5r---menthyl s-p-toluenesulfinate,4-methylbenzenesulfinic acid 1r,5r-2-isopropyl-5-methylcyclohexyl ester
IUPAC Name	[(1R,5R)-5-methyl-2-propan-2-ylcyclohexyl] 4-methylbenzenesulfinate
InChI Key	NQICGNSARVCSGJ-DSRNLFJRSA-N
Molecular Formula	C17H26O2S

290

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

Pricing & Availability
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

291

Dichloro(p-cymene)ruthenium(II) Dimer 95.0+%, TCI America™

CAS: 52462-29-0 Molecular Formula: C20H28Cl4Ru2 Molecular Weight (g/mol): 612.384 MDL Number: MFCD00064793 InChI Key: LAXRNWSASWOFOT-UHFFFAOYSA-J Synonym: dichloro p-cymene ruthenium ii dimer,di-mu-chloro-bis chloro p-cymene ruthenium ii,rucl2 p-cymene 2,ru p-cymene cl2 2,dichloro p-cymene ruthenium dimer,p-cymene ruthenium ii chloride dimer,dichloro-p-cymene ruthenium ii dimer PubChem CID: 10908223 IUPAC Name: dichlororuthenium;1-methyl-4-propan-2-ylbenzene SMILES: CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl

Pricing & Availability
Specifications

PubChem CID	10908223
CAS	52462-29-0
Molecular Weight (g/mol)	612.384
MDL Number	MFCD00064793
SMILES	CC1=CC=C(C=C1)C(C)C.CC1=CC=C(C=C1)C(C)C.Cl[Ru]Cl.Cl[Ru]Cl
Synonym	dichloro p-cymene ruthenium ii dimer,di-mu-chloro-bis chloro p-cymene ruthenium ii,rucl2 p-cymene 2,ru p-cymene cl2 2,dichloro p-cymene ruthenium dimer,p-cymene ruthenium ii chloride dimer,dichloro-p-cymene ruthenium ii dimer
IUPAC Name	dichlororuthenium;1-methyl-4-propan-2-ylbenzene
InChI Key	LAXRNWSASWOFOT-UHFFFAOYSA-J
Molecular Formula	C20H28Cl4Ru2

292

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

Pricing & Availability
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

293

RuCl[(R,R)-Fsdpen](p-cymene) 90.0+%, TCI America™

CAS: 1026995-71-0 Molecular Formula: C30H28ClF5N2O2RuS Molecular Weight (g/mol): 712.138 MDL Number: MFCD12545963 InChI Key: UWFMZLATRGEOIW-ZJPTYAPPSA-M Synonym: [(R,R)-N-(2-Amino-1,2-diphenylethyl)pentafluorobenzenesulfonamide]chloro(p-cymene)ruthenium(II), Chloro(p-cymene)[(R,R)-N-(pentafluorobenzenesulfonyl)-1,2-diphenylethylenediamine]ruthenium(II) PubChem CID: 71463829 IUPAC Name: [(1R,2R)-2-amino-1,2-diphenylethyl]-(2,3,4,5,6-pentafluorophenyl)sulfonylazanide;1-methyl-4-propan-2-ylbenzene;ruthenium(2+);chloride SMILES: CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)[N-]S(=O)(=O)C3=C(C(=C(C(=C3F)F)F)F)F)N.[Cl-].[Ru+2]

Pricing & Availability
Specifications

PubChem CID	71463829
CAS	1026995-71-0
Molecular Weight (g/mol)	712.138
MDL Number	MFCD12545963
SMILES	CC1=CC=C(C=C1)C(C)C.C1=CC=C(C=C1)C(C(C2=CC=CC=C2)[N-]S(=O)(=O)C3=C(C(=C(C(=C3F)F)F)F)F)N.[Cl-].[Ru+2]
Synonym	[(R,R)-N-(2-Amino-1,2-diphenylethyl)pentafluorobenzenesulfonamide]chloro(p-cymene)ruthenium(II), Chloro(p-cymene)[(R,R)-N-(pentafluorobenzenesulfonyl)-1,2-diphenylethylenediamine]ruthenium(II)
IUPAC Name	[(1R,2R)-2-amino-1,2-diphenylethyl]-(2,3,4,5,6-pentafluorophenyl)sulfonylazanide;1-methyl-4-propan-2-ylbenzene;ruthenium(2+);chloride
InChI Key	UWFMZLATRGEOIW-ZJPTYAPPSA-M
Molecular Formula	C30H28ClF5N2O2RuS

294

(+)-Fenchone 98.0+%, TCI America™

CAS: 4695-62-9 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.237 MDL Number: MFCD00070689 InChI Key: LHXDLQBQYFFVNW-XCBNKYQSSA-N Synonym: +-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one PubChem CID: 1201521 ChEBI: CHEBI:165 IUPAC Name: (1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one SMILES: CC1(C2CCC(C2)(C1=O)C)C

Pricing & Availability
Specifications

PubChem CID	1201521
CAS	4695-62-9
Molecular Weight (g/mol)	152.237
ChEBI	CHEBI:165
MDL Number	MFCD00070689
SMILES	CC1(C2CCC(C2)(C1=O)C)C
Synonym	+-fenchone,1s-1,3,3-trimethylbicyclo 2.2.1 heptan-2-one,1s-1,3,3-trimethyl-norbornan-2-one
IUPAC Name	(1R,4S)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-one
InChI Key	LHXDLQBQYFFVNW-XCBNKYQSSA-N
Molecular Formula	C10H16O

295

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

Pricing & Availability
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

296

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

Pricing & Availability
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

297

N-Ethyl-p-menthane-3-carboxamide 98.0+%, TCI America™

CAS: 39711-79-0 Molecular Formula: C13H25NO Molecular Weight (g/mol): 211.35 MDL Number: MFCD00130071 InChI Key: VUNOFAIHSALQQH-UHFFFAOYNA-N Synonym: n-ethyl-p-menthane-3-carboxamide,ethyl menthane carboxamide,n-ethyl-2-isopropyl-5-methylcyclohexanecarboxamide,ws-3,n-ethyl-4-menthane-3-carboxamide,cyclohexanecarboxamide, n-ethyl-5-methyl-2-1-methylethyl,fema no. 3455,ws 3,n-ethyl-2-isopropyl-5-methylcyclohexane carboxamide PubChem CID: 62907 IUPAC Name: N-ethyl-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide SMILES: CCNC(=O)C1CC(C)CCC1C(C)C

Pricing & Availability
Specifications

PubChem CID	62907
CAS	39711-79-0
Molecular Weight (g/mol)	211.35
MDL Number	MFCD00130071
SMILES	CCNC(=O)C1CC(C)CCC1C(C)C
Synonym	n-ethyl-p-menthane-3-carboxamide,ethyl menthane carboxamide,n-ethyl-2-isopropyl-5-methylcyclohexanecarboxamide,ws-3,n-ethyl-4-menthane-3-carboxamide,cyclohexanecarboxamide, n-ethyl-5-methyl-2-1-methylethyl,fema no. 3455,ws 3,n-ethyl-2-isopropyl-5-methylcyclohexane carboxamide
IUPAC Name	N-ethyl-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide
InChI Key	VUNOFAIHSALQQH-UHFFFAOYNA-N
Molecular Formula	C13H25NO

298

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

Pricing & Availability
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

299

Thymol, Purified, Reagents

CAS: 89-83-8 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 InChI Key: MGSRCZKZVOBKFT-UHFFFAOYSA-N Synonym: Thyme camphor, 2-Isopropyl-5-methylphenol, 5-Methyl-2-isopropylphenol IUPAC Name: 5-methyl-2-(propan-2-yl)phenol SMILES: CC(C)C1=CC=C(C)C=C1O

Pricing & Availability
Specifications

CAS	89-83-8
Molecular Weight (g/mol)	150.22
SMILES	CC(C)C1=CC=C(C)C=C1O
Synonym	Thyme camphor, 2-Isopropyl-5-methylphenol, 5-Methyl-2-isopropylphenol
IUPAC Name	5-methyl-2-(propan-2-yl)phenol
InChI Key	MGSRCZKZVOBKFT-UHFFFAOYSA-N
Molecular Formula	C10H14O

300

Thymolphthalein, ACS Grade, LabChem™

CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.544 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

Pricing & Availability
Specifications

PubChem CID	31316
CAS	125-20-2
Molecular Weight (g/mol)	430.544
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

Monoterpenoids

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