2,4-DIMETHYL-1-PENTANOL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C7H16O
Molecular Weight	116.2013
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4-DIMETHYL-1-PENTANOL

Structure Search

SMILES

CC(C)CC(C)CO

InChI

InChIKey=OVOVDHYEOQJKMD-UHFFFAOYSA-N

InChI=1S/C7H16O/c1-6(2)4-7(3)5-8/h6-8H,4-5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C7H16O
Molecular Weight	116.2013
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 11:27:38 GMT 2025` Edited by `admin` on `Wed Apr 02 11:27:38 GMT 2025`
Record UNII	M8SG4FSL86
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4-DIMETHYL-1-PENTANOL

Systematic Name

English

NSC-41179

Preferred Name

English

1-PENTANOL, 2,4-DIMETHYL-

Systematic Name

English

2,4-DIMETHYLPENTAN-1-OL

Systematic Name

English

Code System Code Type Description

FDA UNII

M8SG4FSL86

Created by admin on Wed Apr 02 11:27:38 GMT 2025 , Edited by admin on Wed Apr 02 11:27:38 GMT 2025

PRIMARY

NSC

41179

Created by admin on Wed Apr 02 11:27:38 GMT 2025 , Edited by admin on Wed Apr 02 11:27:38 GMT 2025

PRIMARY

PUBCHEM

22749

Created by admin on Wed Apr 02 11:27:38 GMT 2025 , Edited by admin on Wed Apr 02 11:27:38 GMT 2025

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CAS

6305-71-1

Created by admin on Wed Apr 02 11:27:38 GMT 2025 , Edited by admin on Wed Apr 02 11:27:38 GMT 2025

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EPA CompTox

DTXSID50875705

Created by admin on Wed Apr 02 11:27:38 GMT 2025 , Edited by admin on Wed Apr 02 11:27:38 GMT 2025

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2,4-DIMETHYL-1-PENTANOL, (S)-

ENANTIOMER -> RACEMATE

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