Phenylpropanes

Organic compound that contain a propane chain with a phenyl substitution in the following structure: C₆H₅CH₂CH2CH3. These compounds are considered hydrocarbons.

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1 – 15 of 37 results

3,9-Bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane 95.0+%, TCI America™

CAS: 26741-53-7 Molecular Formula: C33H50O6P2 Molecular Weight (g/mol): 604.71 MDL Number: MFCD00071521 InChI Key: AIBRSVLEQRWAEG-FJGSWBKINA-N Synonym: Pentaerythritol Bis(2,4-di-tert-butylphenylphosphite) PubChem CID: 93101 IUPAC Name: 3,9-bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane SMILES: CC(C)(C)C1=CC=C(O[P@]2OC[C@]3(CO[P@](OC4=CC=C(C=C4C(C)(C)C)C(C)(C)C)OC3)CO2)C(=C1)C(C)(C)C

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PubChem CID	93101
CAS	26741-53-7
Molecular Weight (g/mol)	604.71
MDL Number	MFCD00071521
SMILES	CC(C)(C)C1=CC=C(O[P@]2OC[C@]3(CO[P@](OC4=CC=C(C=C4C(C)(C)C)C(C)(C)C)OC3)CO2)C(=C1)C(C)(C)C
Synonym	Pentaerythritol Bis(2,4-di-tert-butylphenylphosphite)
IUPAC Name	3,9-bis(2,4-di-tert-butylphenoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
InChI Key	AIBRSVLEQRWAEG-FJGSWBKINA-N
Molecular Formula	C33H50O6P2

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1,3-Di-tert-butyl-2-methoxybenzene, 99%

CAS: 1516-95-6 Molecular Formula: C15H24O Molecular Weight (g/mol): 220.36 MDL Number: MFCD20483412 InChI Key: OGIJRUWUWSZKAV-UHFFFAOYSA-N Synonym: 1,3-di-tert-butyl-2-methoxybenzene,benzene, 1,3-bis 1,1-dimethylethyl-2-methoxy,2,6-di-tert-butylanisole PubChem CID: 12794694 IUPAC Name: 1,3-ditert-butyl-2-methoxybenzene SMILES: COC1=C(C=CC=C1C(C)(C)C)C(C)(C)C

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PubChem CID	12794694
CAS	1516-95-6
Molecular Weight (g/mol)	220.36
MDL Number	MFCD20483412
SMILES	COC1=C(C=CC=C1C(C)(C)C)C(C)(C)C
Synonym	1,3-di-tert-butyl-2-methoxybenzene,benzene, 1,3-bis 1,1-dimethylethyl-2-methoxy,2,6-di-tert-butylanisole
IUPAC Name	1,3-ditert-butyl-2-methoxybenzene
InChI Key	OGIJRUWUWSZKAV-UHFFFAOYSA-N
Molecular Formula	C15H24O

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tert-Pentylbenzene, 97%

CAS: 2049-95-8 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00015187 InChI Key: QHTJSSMHBLGUHV-UHFFFAOYSA-N Synonym: tert-amylbenzene,tert-pentylbenzene,2-methyl-2-phenylbutane,1,1-dimethylpropyl benzene,benzene, 1,1-dimethylpropyl,benzene, tert-pentyl,2-phenyl-2-methylbutane,t-amylbenzene,2-methylbutan-2-yl benzene,tert-amyl benzene PubChem CID: 16295 IUPAC Name: 2-methylbutan-2-ylbenzene SMILES: CCC(C)(C)C1=CC=CC=C1

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PubChem CID	16295
CAS	2049-95-8
Molecular Weight (g/mol)	148.249
MDL Number	MFCD00015187
SMILES	CCC(C)(C)C1=CC=CC=C1
Synonym	tert-amylbenzene,tert-pentylbenzene,2-methyl-2-phenylbutane,1,1-dimethylpropyl benzene,benzene, 1,1-dimethylpropyl,benzene, tert-pentyl,2-phenyl-2-methylbutane,t-amylbenzene,2-methylbutan-2-yl benzene,tert-amyl benzene
IUPAC Name	2-methylbutan-2-ylbenzene
InChI Key	QHTJSSMHBLGUHV-UHFFFAOYSA-N
Molecular Formula	C11H16

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3,4-Dimethoxyphenylacetone, 97%

CAS: 776-99-8 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008772 InChI Key: UMYZWICEDUEWIM-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone PubChem CID: 69896 IUPAC Name: 1-(3,4-dimethoxyphenyl)propan-2-one SMILES: COC1=CC=C(CC(C)=O)C=C1OC

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PubChem CID	69896
CAS	776-99-8
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00008772
SMILES	COC1=CC=C(CC(C)=O)C=C1OC
Synonym	3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone
IUPAC Name	1-(3,4-dimethoxyphenyl)propan-2-one
InChI Key	UMYZWICEDUEWIM-UHFFFAOYSA-N
Molecular Formula	C11H14O3

1,3-Bis(2-isocyanato-2-propyl)benzene 97.0+%, TCI America™

CAS: 2778-42-9 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00142493 InChI Key: AZYRZNIYJDKRHO-UHFFFAOYSA-N Synonym: 1,3-Bis(1-isocyanato-1-methylethyl)benzene PubChem CID: 17719 IUPAC Name: 1,3-bis(2-isocyanatopropan-2-yl)benzene SMILES: CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O

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PubChem CID	17719
CAS	2778-42-9
Molecular Weight (g/mol)	244.294
MDL Number	MFCD00142493
SMILES	CC(C)(C1=CC(=CC=C1)C(C)(C)N=C=O)N=C=O
Synonym	1,3-Bis(1-isocyanato-1-methylethyl)benzene
IUPAC Name	1,3-bis(2-isocyanatopropan-2-yl)benzene
InChI Key	AZYRZNIYJDKRHO-UHFFFAOYSA-N
Molecular Formula	C14H16N2O2

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1-Phenyl-1,2-propanedione-2-oxime, 99%

CAS: 119-51-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00002115 InChI Key: YPINLRNGSGGJJT-JXMROGBWSA-N Synonym: 1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone PubChem CID: 9566063 IUPAC Name: (2E)-2-hydroxyimino-1-phenylpropan-1-one SMILES: C\C(=N/O)C(=O)C1=CC=CC=C1

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PubChem CID	9566063
CAS	119-51-7
Molecular Weight (g/mol)	163.18
MDL Number	MFCD00002115
SMILES	C\C(=N/O)C(=O)C1=CC=CC=C1
Synonym	1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone
IUPAC Name	(2E)-2-hydroxyimino-1-phenylpropan-1-one
InChI Key	YPINLRNGSGGJJT-JXMROGBWSA-N
Molecular Formula	C9H9NO2

alpha,alpha-Dimethylphenylacetic acid

CAS: 826-55-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00014332 InChI Key: YYEROYLAYAVZNW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl PubChem CID: 13222 IUPAC Name: 2-methyl-2-phenylpropanoic acid SMILES: CC(C)(C(O)=O)C1=CC=CC=C1

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PubChem CID	13222
CAS	826-55-1
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00014332
SMILES	CC(C)(C(O)=O)C1=CC=CC=C1
Synonym	2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl
IUPAC Name	2-methyl-2-phenylpropanoic acid
InChI Key	YYEROYLAYAVZNW-UHFFFAOYSA-N
Molecular Formula	C10H12O2

4-Isobutylbenzoic Acid 99.0+%, TCI America™

CAS: 38861-88-0 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00191658 InChI Key: VUBBCFWWSKOHTH-UHFFFAOYSA-N PubChem CID: 38111 IUPAC Name: 4-(2-methylpropyl)benzoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(O)=O

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PubChem CID	38111
CAS	38861-88-0
Molecular Weight (g/mol)	178.23
MDL Number	MFCD00191658
SMILES	CC(C)CC1=CC=C(C=C1)C(O)=O
IUPAC Name	4-(2-methylpropyl)benzoic acid
InChI Key	VUBBCFWWSKOHTH-UHFFFAOYSA-N
Molecular Formula	C11H14O2

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2-sec-Butylphenol, 98%

CAS: 89-72-5 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002225 InChI Key: NGFPWHGISWUQOI-UHFFFAOYSA-N Synonym: 2-sec-butylphenol,o-sec-butylphenol,2-1-methylpropyl phenol,2-2-butyl phenol,phenol, 2-1-methylpropyl,2-butan-2-yl phenol,phenol, o-sec-butyl,2-sec.butylfenol,isopropyl o-cresol,2-sec.butylfenol czech PubChem CID: 6984 ChEBI: CHEBI:34303 IUPAC Name: 2-butan-2-ylphenol SMILES: CCC(C)C1=CC=CC=C1O

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PubChem CID	6984
CAS	89-72-5
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:34303
MDL Number	MFCD00002225
SMILES	CCC(C)C1=CC=CC=C1O
Synonym	2-sec-butylphenol,o-sec-butylphenol,2-1-methylpropyl phenol,2-2-butyl phenol,phenol, 2-1-methylpropyl,2-butan-2-yl phenol,phenol, o-sec-butyl,2-sec.butylfenol,isopropyl o-cresol,2-sec.butylfenol czech
IUPAC Name	2-butan-2-ylphenol
InChI Key	NGFPWHGISWUQOI-UHFFFAOYSA-N
Molecular Formula	C10H14O

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2-Methyl-2-phenylpropanenitrile, 97%

CAS: 1195-98-8 Molecular Formula: C₁₀H₁₁N Molecular Weight (g/mol): 145.21 InChI Key: PGQTYXFMSZUGOW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenyl-propionitrile,phenylisobutyronitrile,2-phenylisobutyronitrile,2-methyl-2-phenylpropionitrile,2-methyl-2-phenyl-propanenitrile,alpha,alpha-dimethylbenzyl cyanide,benzeneacetonitrile,a,a-dimethyl,alpha,alpha-dimethylphenylacetonitrile,benzeneacetonitrile,,a,,a-dimethyl,benzeneacetonitrile, alpha,alpha-dimethyl PubChem CID: 2797591 IUPAC Name: 2-methyl-2-phenylpropanenitrile SMILES: CC(C)(C#N)C1=CC=CC=C1

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PubChem CID	2797591
CAS	1195-98-8
Molecular Weight (g/mol)	145.21
SMILES	CC(C)(C#N)C1=CC=CC=C1
Synonym	2-methyl-2-phenyl-propionitrile,phenylisobutyronitrile,2-phenylisobutyronitrile,2-methyl-2-phenylpropionitrile,2-methyl-2-phenyl-propanenitrile,alpha,alpha-dimethylbenzyl cyanide,benzeneacetonitrile,a,a-dimethyl,alpha,alpha-dimethylphenylacetonitrile,benzeneacetonitrile,,a,,a-dimethyl,benzeneacetonitrile, alpha,alpha-dimethyl
IUPAC Name	2-methyl-2-phenylpropanenitrile
InChI Key	PGQTYXFMSZUGOW-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₁N

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4-Methoxyphenylacetone, 98+%

CAS: 122-84-9 Molecular Formula: C₁₀H₁₂O₂ Molecular Weight (g/mol): 164.2 MDL Number: MFCD00008773 InChI Key: WFWKNGZODAOLEO-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetone,p-acetonylanisole,anisketone,1-4-methoxyphenyl propan-2-one,2-propanone, 1-4-methoxyphenyl,anisyl methyl ketone,p-methoxyphenylacetone,4-methoxybenzyl methyl ketone,1-p-methoxyphenyl-2-propanone,anisic ketone PubChem CID: 31231 IUPAC Name: 1-(4-methoxyphenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(C=C1)OC

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PubChem CID	31231
CAS	122-84-9
Molecular Weight (g/mol)	164.2
MDL Number	MFCD00008773
SMILES	CC(=O)CC1=CC=C(C=C1)OC
Synonym	4-methoxyphenylacetone,p-acetonylanisole,anisketone,1-4-methoxyphenyl propan-2-one,2-propanone, 1-4-methoxyphenyl,anisyl methyl ketone,p-methoxyphenylacetone,4-methoxybenzyl methyl ketone,1-p-methoxyphenyl-2-propanone,anisic ketone
IUPAC Name	1-(4-methoxyphenyl)propan-2-one
InChI Key	WFWKNGZODAOLEO-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₂O₂

2-[3,5-di(tert-butyl)-4-hydroxyphenyl]acetic acid, Thermo Scientific™

CAS: 1611-03-6 Molecular Formula: C16H24O3 Molecular Weight (g/mol): 264.365 InChI Key: QLMGIWHWWWXXME-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxyphenylacetic acid,3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,benzeneacetic acid,3,5-bis 1,1-dimethylethyl-4-hydroxy,acmc-1bvft,4-hydroxy-3,5-di-t-butylphenylacetic acid,3,5-di-t-butyl-4-hydroxyphenyl-acetic acid,4-hydroxy-3,5-di-t-butyl-phenylacetic acid,3,5-di-tert-butyl-4-hydroxybenzeneacetic acid PubChem CID: 2775110 IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)O

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PubChem CID	2775110
CAS	1611-03-6
Molecular Weight (g/mol)	264.365
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(=O)O
Synonym	3,5-di-tert-butyl-4-hydroxyphenylacetic acid,3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di tert-butyl-4-hydroxyphenyl acetic acid,2-3,5-di-tert-butyl-4-hydroxyphenyl acetic acid,benzeneacetic acid,3,5-bis 1,1-dimethylethyl-4-hydroxy,acmc-1bvft,4-hydroxy-3,5-di-t-butylphenylacetic acid,3,5-di-t-butyl-4-hydroxyphenyl-acetic acid,4-hydroxy-3,5-di-t-butyl-phenylacetic acid,3,5-di-tert-butyl-4-hydroxybenzeneacetic acid
IUPAC Name	2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid
InChI Key	QLMGIWHWWWXXME-UHFFFAOYSA-N
Molecular Formula	C16H24O3

Probucol, MP Biomedicals™

CAS: 23288-49-5 Molecular Formula: C31H48O2S2 Molecular Weight (g/mol): 516.843 InChI Key: FYPMFJGVHOHGLL-UHFFFAOYSA-N Synonym: probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum PubChem CID: 4912 ChEBI: CHEBI:8427 IUPAC Name: 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

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PubChem CID	4912
CAS	23288-49-5
Molecular Weight (g/mol)	516.843
ChEBI	CHEBI:8427
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
Synonym	probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum
IUPAC Name	2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol
InChI Key	FYPMFJGVHOHGLL-UHFFFAOYSA-N
Molecular Formula	C31H48O2S2

Polyethylene Glycol Mono-4-octylphenyl Ether (n=approx. 10), TCI America™

CAS: 9002-93-1 Molecular Formula: C16H26O2 Molecular Weight (g/mol): 250.38 MDL Number: MFCD00132505 InChI Key: JYCQQPHGFMYQCF-UHFFFAOYSA-N Synonym: triton x-100,triton x,octoxynol,preceptin,triton x-45,triton x 45,octoxynol-3,octoxynol-9,hydrol sw,triton x 100 PubChem CID: 5590 IUPAC Name: 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethan-1-ol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(OCCO)C=C1

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PubChem CID	5590
CAS	9002-93-1
Molecular Weight (g/mol)	250.38
MDL Number	MFCD00132505
SMILES	CC(C)(C)CC(C)(C)C1=CC=C(OCCO)C=C1
Synonym	triton x-100,triton x,octoxynol,preceptin,triton x-45,triton x 45,octoxynol-3,octoxynol-9,hydrol sw,triton x 100
IUPAC Name	2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethan-1-ol
InChI Key	JYCQQPHGFMYQCF-UHFFFAOYSA-N
Molecular Formula	C16H26O2

Hexestrol 98.0+%, TCI America™

CAS: 84-16-2 Molecular Formula: C18H22O2 Molecular Weight (g/mol): 270.37 MDL Number: MFCD00068996 InChI Key: PBBGSZCBWVPOOL-UHFFFAOYNA-N Synonym: hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar PubChem CID: 192197 IUPAC Name: 4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol SMILES: CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1

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PubChem CID	192197
CAS	84-16-2
Molecular Weight (g/mol)	270.37
MDL Number	MFCD00068996
SMILES	CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonym	hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar
IUPAC Name	4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol
InChI Key	PBBGSZCBWVPOOL-UHFFFAOYNA-N
Molecular Formula	C18H22O2

Phenylpropanes

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