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Details

Stereochemistry RACEMIC
Molecular Formula C10H14O
Molecular Weight 150.2176
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-SEC-BUTYLPHENOL

SMILES

CCC(C)C1=CC=CC=C1O

InChI

InChIKey=NGFPWHGISWUQOI-UHFFFAOYSA-N
InChI=1S/C10H14O/c1-3-8(2)9-6-4-5-7-10(9)11/h4-8,11H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H14O
Molecular Weight 150.2176
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Changing the substrate reactivity of 2-hydroxybiphenyl 3-monooxygenase from Pseudomonas azelaica HBP1 by directed evolution.
2002 Feb 15
Study of 202 natural, synthetic, and environmental chemicals for binding to the androgen receptor.
2003 Oct
Determination of four kinds of carbamate pesticides by capillary zone electrophoresis with amperometric detection at a polyamide-modified carbon paste electrode.
2007 Feb 28
Isolation and characterization of a novel 2-sec-butylphenol-degrading bacterium Pseudomonas sp. strain MS-1.
2010 Apr
Rat α-Fetoprotein binding affinities of a large set of structurally diverse chemicals elucidated the relationships between structures and binding affinities.
2012 Nov 19
Human sex hormone-binding globulin binding affinities of 125 structurally diverse chemicals and comparison with their binding to androgen receptor, estrogen receptor, and α-fetoprotein.
2015 Feb
Substance Class Chemical
Created
by admin
on Sat Dec 16 00:40:01 GMT 2023
Edited
by admin
on Sat Dec 16 00:40:01 GMT 2023
Record UNII
025P24OTM5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-SEC-BUTYLPHENOL
Systematic Name English
PHENOL, 2-(1-METHYLPROPYL)-
Systematic Name English
2-(1-METHYLPROPYL)PHENOL
HSDB  
Systematic Name English
O-SEC.-BUTYLPHENOL
Common Name English
2-(1-METHYLPROPYL)PHENOL [HSDB]
Common Name English
ETHANONE, 1- (2, 4-DIMETHYLPHENYL)-
Common Name English
(±)-2-SEC-BUTYLPHENOL
Systematic Name English
1-HYDROXY-2-(1-METHYLPROPYL)BENZENE
Systematic Name English
2', 4'-DIMETHYLACETOPHENONE
Systematic Name English
O-SEC-BUTYLPHENOL
Systematic Name English
2-(BUTAN-2-YL)PHENOL
Systematic Name English
Code System Code Type Description
CAS
89-72-5
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
MESH
C033932
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
CHEBI
34303
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
PUBCHEM
6984
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-933-8
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
HSDB
5266
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
FDA UNII
025P24OTM5
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
WIKIPEDIA
o-sec-Butylphenol
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID2022331
Created by admin on Sat Dec 16 00:40:01 GMT 2023 , Edited by admin on Sat Dec 16 00:40:01 GMT 2023
PRIMARY