2,6-DIMETHYLHEPTAN-3-ONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H18O
Molecular Weight	142.2386
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,6-DIMETHYLHEPTAN-3-ONE

Structure Search

SMILES

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

InChI

InChIKey=HFNWDYQEGABWQS-UHFFFAOYSA-N

InChI=1S/C9H18O/c1-7(2)5-6-9(10)8(3)4/h7-8H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C9H18O
Molecular Weight	142.2386
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 `Fri Dec 15 19:34:43 GMT 2023` Edited by `admin` on `Fri Dec 15 19:34:43 GMT 2023`
Record UNII	56924GH37X
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,6-DIMETHYLHEPTAN-3-ONE

Systematic Name

English

2,6-DIMETHYL-3-HEPTANONE

Systematic Name

English

3-HEPTANONE, 2,6-DIMETHYL-

Systematic Name

English

NSC-155180

Code

English

Code System Code Type Description

FDA UNII

56924GH37X

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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CAS

19549-83-8

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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PUBCHEM

88149

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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ECHA (EC/EINECS)

243-149-9

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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EPA CompTox

DTXSID20173220

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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NSC

155180

Created by admin on Fri Dec 15 19:34:43 GMT 2023 , Edited by admin on Fri Dec 15 19:34:43 GMT 2023

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