2,4,6-HEPTANETRIONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H10O3
Molecular Weight	142.1525
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=CTHCTLCNUREAJV-UHFFFAOYSA-N

InChI=1S/C7H10O3/c1-5(8)3-7(10)4-6(2)9/h3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H10O3
Molecular Weight	142.1525
Charge	0
Count

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

Approval Year

PubMed

Title	Date	PubMed
Density functional theory study of the Fourier transform infrared and Raman spectra of Cu(II) bis-acetylacetone.	2005-11	16257735

Substance Class	Chemical Created by `admin` on `Mon Mar 31 19:18:01 GMT 2025` Edited by `admin` on `Mon Mar 31 19:18:01 GMT 2025`
Record UNII	A95Z6Y7NCX
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,4,6-HEPTANETRIONE

Systematic Name

English

1,3-DIACETYLACETONE

Preferred Name

English

2-PROPANONE, 1,3-DIACETYL-

Systematic Name

English

DIACETYLACETONE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID60211650

Created by admin on Mon Mar 31 19:18:02 GMT 2025 , Edited by admin on Mon Mar 31 19:18:02 GMT 2025

PRIMARY

CAS

626-53-9

Created by admin on Mon Mar 31 19:18:02 GMT 2025 , Edited by admin on Mon Mar 31 19:18:02 GMT 2025

PRIMARY

PUBCHEM

12285

Created by admin on Mon Mar 31 19:18:02 GMT 2025 , Edited by admin on Mon Mar 31 19:18:02 GMT 2025

PRIMARY

FDA UNII

A95Z6Y7NCX

Created by admin on Mon Mar 31 19:18:02 GMT 2025 , Edited by admin on Mon Mar 31 19:18:02 GMT 2025

PRIMARY