4-(1-Methylbutyl)phenol

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C11H16O
Molecular Weight	164.2441
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(1-Methylbutyl)phenol

Structure Search

SMILES

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

InChI

InChIKey=JTHGIRIGZAGNOX-UHFFFAOYSA-N

InChI=1S/C11H16O/c1-3-4-9(2)10-5-7-11(12)8-6-10/h5-9,12H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C11H16O
Molecular Weight	164.2441
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:10:02 GMT 2025` Edited by `admin` on `Wed Apr 02 11:10:02 GMT 2025`
Record UNII	MCX7ZXE8SC
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

4-(1-Methylbutyl)phenol

Systematic Name

English

NSC-7947

Preferred Name

English

p-(1-Methylbutyl)phenol

Systematic Name

English

Phenol, 4-(1-methylbutyl)-

Systematic Name

English

Phenol, p-(1-methylbutyl)-

Systematic Name

English

2-(4-Hydroxyphenyl)pentane

Systematic Name

English

Code System Code Type Description

CAS

94-06-4

Created by admin on Wed Apr 02 11:10:02 GMT 2025 , Edited by admin on Wed Apr 02 11:10:02 GMT 2025

PRIMARY

PUBCHEM

7171

Created by admin on Wed Apr 02 11:10:02 GMT 2025 , Edited by admin on Wed Apr 02 11:10:02 GMT 2025

PRIMARY

EPA CompTox

DTXSID40904255

Created by admin on Wed Apr 02 11:10:02 GMT 2025 , Edited by admin on Wed Apr 02 11:10:02 GMT 2025

PRIMARY

FDA UNII

MCX7ZXE8SC

Created by admin on Wed Apr 02 11:10:02 GMT 2025 , Edited by admin on Wed Apr 02 11:10:02 GMT 2025

PRIMARY

NSC

7947

Created by admin on Wed Apr 02 11:10:02 GMT 2025 , Edited by admin on Wed Apr 02 11:10:02 GMT 2025

PRIMARY

Related Record Type Details


					WMV365S5J7

4-[(1S)-1-Methylbutyl]phenol

ENANTIOMER -> RACEMATE

Amount: