4-(1,3-DIMETHYL-1-PROPYLBUTYL)PHENOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H24O
Molecular Weight	220.3505
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(1,3-DIMETHYL-1-PROPYLBUTYL)PHENOL

Structure Search

SMILES

CCCC(C)(CC(C)C)C1=CC=C(O)C=C1

InChI

InChIKey=QQEAMCHVFKIIGX-UHFFFAOYSA-N

InChI=1S/C15H24O/c1-5-10-15(4,11-12(2)3)13-6-8-14(16)9-7-13/h6-9,12,16H,5,10-11H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C15H24O
Molecular Weight	220.3505
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Title	Date	PubMed
Estrogen equivalent concentration of 13 branched para-nonylphenols in three technical mixtures by isomer-specific determination using their synthetic standards in SIM mode with GC-MS and two new diasteromeric isomers.	2008-02	17997468
Variation in estrogenic activity among fractions of a commercial nonylphenol by high performance liquid chromatography.	2004-02	14664841

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:04:22 GMT 2025` Edited by `admin` on `Mon Mar 31 21:04:22 GMT 2025`
Record UNII	Z7L7190Y06
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(±)-4-(1,3-DIMETHYL-1-PROPYLBUTYL)PHENOL

Preferred Name

English

4-(1,3-DIMETHYL-1-PROPYLBUTYL)PHENOL

Systematic Name

English

PHENOL, 4-(1,3-DIMETHYL-1-PROPYLBUTYL)-

Systematic Name

English

4-(1,3-DIMETHYL-1-PROPYLBUTYL)PHENOL, (±)-

Systematic Name

English

Code System Code Type Description

CAS

142731-65-5

Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025

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EPA CompTox

DTXSID101339669

Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025

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FDA UNII

Z7L7190Y06

Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025

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PUBCHEM

71344407

Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025

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