6-HYDROXY-6-METHYL-2-HEPTANONE

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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-2-HEPTANONE

Structure Search

SMILES

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

InChI

InChIKey=BDKJAPPUGXLAHC-UHFFFAOYSA-N

InChI=1S/C8H16O2/c1-7(9)5-4-6-8(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 `Wed Apr 02 12:16:40 GMT 2025` Edited by `admin` on `Wed Apr 02 12:16:40 GMT 2025`
Record UNII	DZ7EM846KL
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

6-HYDROXY-6-METHYL-2-HEPTANONE

Systematic Name

English

6-HYDROXY-6-METHYLHEPTAN-2-ONE

Preferred Name

English

2-HEPTANONE, 6-HYDROXY-6-METHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID50198805

Created by admin on Wed Apr 02 12:16:40 GMT 2025 , Edited by admin on Wed Apr 02 12:16:40 GMT 2025

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CAS

5077-57-6

Created by admin on Wed Apr 02 12:16:40 GMT 2025 , Edited by admin on Wed Apr 02 12:16:40 GMT 2025

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ECHA (EC/EINECS)

225-789-0

Created by admin on Wed Apr 02 12:16:40 GMT 2025 , Edited by admin on Wed Apr 02 12:16:40 GMT 2025

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FDA UNII

DZ7EM846KL

Created by admin on Wed Apr 02 12:16:40 GMT 2025 , Edited by admin on Wed Apr 02 12:16:40 GMT 2025

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PUBCHEM

78762

Created by admin on Wed Apr 02 12:16:40 GMT 2025 , Edited by admin on Wed Apr 02 12:16:40 GMT 2025

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