5-METHYL-1-HEXANOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H16O
Molecular Weight	116.2013
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-METHYL-1-HEXANOL

Structure Search

SMILES

CC(C)CCCCO

InChI

InChIKey=ZVHAANQOQZVVFD-UHFFFAOYSA-N

InChI=1S/C7H16O/c1-7(2)5-3-4-6-8/h7-8H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H16O
Molecular Weight	116.2013
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:48:03 GMT 2025` Edited by `admin` on `Mon Mar 31 17:48:03 GMT 2025`
Record UNII	1PLY0QE25K
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-HEXANOL, 5-METHYL-

Preferred Name

English

5-METHYL-1-HEXANOL

Systematic Name

English

5-METHYLHEXAN-1-OL

Systematic Name

English

5-METHYLHEXANOL

Systematic Name

English

Code System Code Type Description

FDA UNII

1PLY0QE25K

Created by admin on Mon Mar 31 17:48:04 GMT 2025 , Edited by admin on Mon Mar 31 17:48:04 GMT 2025

PRIMARY

PUBCHEM

12331

Created by admin on Mon Mar 31 17:48:04 GMT 2025 , Edited by admin on Mon Mar 31 17:48:04 GMT 2025

PRIMARY

CAS

627-98-5

Created by admin on Mon Mar 31 17:48:04 GMT 2025 , Edited by admin on Mon Mar 31 17:48:04 GMT 2025

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EPA CompTox

DTXSID501031584

Created by admin on Mon Mar 31 17:48:04 GMT 2025 , Edited by admin on Mon Mar 31 17:48:04 GMT 2025

PRIMARY

ECHA (EC/EINECS)

211-023-2

Created by admin on Mon Mar 31 17:48:04 GMT 2025 , Edited by admin on Mon Mar 31 17:48:04 GMT 2025

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