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Details

Stereochemistry MIXED
Molecular Formula C15H24O
Molecular Weight 220.3505
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(1-ETHYL-1,3-DIMETHYLPENTYL)PHENOL

SMILES

CCC(C)CC(C)(CC)C1=CC=C(O)C=C1

InChI

InChIKey=RYIHVIPUIXFRNI-UHFFFAOYSA-N
InChI=1S/C15H24O/c1-5-12(3)11-15(4,6-2)13-7-9-14(16)10-8-13/h7-10,12,16H,5-6,11H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C15H24O
Molecular Weight 220.3505
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Bioaccumulation and bound-residue formation of a branched 4-nonylphenol isomer in the geophagous earthworm Metaphire guillelmi in a rice paddy soil.
2010-06-15
Impact of bio-augmentation with Sphingomonas sp. strain TTNP3 in membrane bioreactors degrading nonylphenol.
2009-08
Separation, synthesis and estrogenic activity of 4-nonylphenols: two sets of new diastereomeric isomers in a commercial mixture.
2008-11
Syntheses and estrogenic activity of 4-nonylphenol isomers.
2008-08
Contribution to the Detection and Identification of Oxidation Metabolites of Nonylphenol in Sphingomonas sp. strain TTNP3.
2007-04
Fate of a 14C-labeled nonylphenol isomer in a laboratory-scale membrane bioreactor.
2006-10-01
Identification of isomeric 4-nonylphenol structures by gas chromatography-tandem mass spectrometry combined with cluster analysis.
2006-01-13
Synthesis of branched para-nonylphenol isomers: occurrence and quantification in two commercial mixtures.
2005-09
Degradation of the radioactive and non-labelled branched 4(3',5'-dimethyl 3'-heptyl)-phenol nonylphenol isomer by sphingomonas TTNP3.
2004-02
Bioavailability of a nonylphenol isomer in dependence on the association to dissolved humic substances.
2004
Microbial degradation of a single branched isomer of nonylphenol by Sphingomonas TTNP3.
2004
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
5394ZPD91W
Record Status Validated (UNII)
Record Version
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Name Type Language
4-(1-ETHYL-1,3-DIMETHYLPENTYL)PHENOL
Systematic Name English
P-353NP
Preferred Name English
353 NONYLPHENOL
Common Name English
PHENOL, 4-(1-ETHYL-1,3-DIMETHYLPENTYL)-
Systematic Name English
(±)-4-(1-ETHYL-1,3-DIMETHYLPENTYL)PHENOL
Systematic Name English
Code System Code Type Description
PUBCHEM
53412055
Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025
PRIMARY
CAS
186825-36-5
Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID701029290
Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025
PRIMARY
FDA UNII
5394ZPD91W
Created by admin on Mon Mar 31 21:04:22 GMT 2025 , Edited by admin on Mon Mar 31 21:04:22 GMT 2025
PRIMARY