6-HYDROXY-6-METHYL-HEPTAN-3-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H16O2
Molecular Weight	144.2114
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 6-HYDROXY-6-METHYL-HEPTAN-3-ONE

Structure Search

SMILES

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

InChI

InChIKey=FGPMBONEKHYAHO-UHFFFAOYSA-N

InChI=1S/C8H16O2/c1-4-7(9)5-6-8(2,3)10/h10H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C8H16O2
Molecular Weight	144.2114
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 `Tue Apr 01 16:55:11 GMT 2025` Edited by `admin` on `Tue Apr 01 16:55:11 GMT 2025`
Record UNII	G2CVU7ZB99
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-HEPTANONE, 6-HYDROXY-6-METHYL-

Preferred Name

English

6-HYDROXY-6-METHYL-HEPTAN-3-ONE

Systematic Name

English

6-HYDROXY-6-METHYL-3-HEPTANONE

Systematic Name

English

Code System Code Type Description

CAS

123065-56-5

Created by admin on Tue Apr 01 16:55:11 GMT 2025 , Edited by admin on Tue Apr 01 16:55:11 GMT 2025

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EPA CompTox

DTXSID70153855

Created by admin on Tue Apr 01 16:55:11 GMT 2025 , Edited by admin on Tue Apr 01 16:55:11 GMT 2025

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PUBCHEM

129891

Created by admin on Tue Apr 01 16:55:11 GMT 2025 , Edited by admin on Tue Apr 01 16:55:11 GMT 2025

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FDA UNII

G2CVU7ZB99

Created by admin on Tue Apr 01 16:55:11 GMT 2025 , Edited by admin on Tue Apr 01 16:55:11 GMT 2025

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DRUG BANK

DB03711

Created by admin on Tue Apr 01 16:55:11 GMT 2025 , Edited by admin on Tue Apr 01 16:55:11 GMT 2025

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