2-SEC-BUTYLPHENOL

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 Search

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

Title	Date	PubMed
Changing the substrate reactivity of 2-hydroxybiphenyl 3-monooxygenase from Pseudomonas azelaica HBP1 by directed evolution.	2002 Feb 15	11733527
Study of 202 natural, synthetic, and environmental chemicals for binding to the androgen receptor.	2003 Oct	14565775
Rat α-Fetoprotein binding affinities of a large set of structurally diverse chemicals elucidated the relationships between structures and binding affinities.	2012 Nov 19	23013281
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	25349334

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

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Name

Type

Language

2-SEC-BUTYLPHENOL

Systematic Name

English

PHENOL, 2-(1-METHYLPROPYL)-

Systematic Name

English

2-(1-METHYLPROPYL)PHENOL

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