3,4-Dimethyl-2-hexanol

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NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C8H18O
Molecular Weight	130.2279
Optical Activity	( + / - )
Defined Stereocenters	0 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,4-Dimethyl-2-hexanol

Structure Search

SMILES

CCC(C)C(C)C(C)O

InChI

InChIKey=LBJWJHMCZHKLQU-UHFFFAOYSA-N

InChI=1S/C8H18O/c1-5-6(2)7(3)8(4)9/h6-9H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C8H18O
Molecular Weight	130.2279
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:13:23 GMT 2025` Edited by `admin` on `Wed Apr 02 12:13:23 GMT 2025`
Record UNII	HJU2VAV95A
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-95421

Preferred Name

English

3,4-Dimethyl-2-hexanol

Systematic Name

English

3,4-Dimethylhexan-2-ol

Systematic Name

English

2-Hexanol, 3,4-dimethyl-

Systematic Name

English

Code System Code Type Description

FDA UNII

HJU2VAV95A

Created by admin on Wed Apr 02 12:13:23 GMT 2025 , Edited by admin on Wed Apr 02 12:13:23 GMT 2025

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NSC

95421

Created by admin on Wed Apr 02 12:13:23 GMT 2025 , Edited by admin on Wed Apr 02 12:13:23 GMT 2025

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CAS

19550-05-1

Created by admin on Wed Apr 02 12:13:23 GMT 2025 , Edited by admin on Wed Apr 02 12:13:23 GMT 2025

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EPA CompTox

DTXSID20871299

Created by admin on Wed Apr 02 12:13:23 GMT 2025 , Edited by admin on Wed Apr 02 12:13:23 GMT 2025

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PUBCHEM

140547

Created by admin on Wed Apr 02 12:13:23 GMT 2025 , Edited by admin on Wed Apr 02 12:13:23 GMT 2025

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