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Details

Stereochemistry RACEMIC
Molecular Formula C10H18O2
Molecular Weight 170.2487
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYL-2,4-NONANEDIONE

SMILES

CCCCCC(=O)C(C)C(C)=O

InChI

InChIKey=BGVBGAIWXAXBLP-UHFFFAOYSA-N
InChI=1S/C10H18O2/c1-4-5-6-7-10(12)8(2)9(3)11/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C10H18O2
Molecular Weight 170.2487
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 21:31:54 GMT 2023
Edited
by admin
on Fri Dec 15 21:31:54 GMT 2023
Record UNII
854O7EVF99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYL-2,4-NONANEDIONE
FHFI  
Systematic Name English
3-METHYL-2,4-NONANEDIONE, (±)-
Systematic Name English
(±)-3-METHYL-2,4-NONANEDIONE
Systematic Name English
FEMA NO. 4057
Code English
METHYL NONANE DIONE
Systematic Name English
3-METHYLNONAN-2,4-DIONE
Systematic Name English
3-METHYL-2,4-NONANEDIONE [FHFI]
Common Name English
2,4-NONANEDIONE, 3-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
854O7EVF99
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
PRIMARY
CAS
113486-29-6
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
PRIMARY
PUBCHEM
529481
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
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EPA CompTox
DTXSID10869569
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
PRIMARY
JECFA MONOGRAPH
2010
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
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MESH
C475572
Created by admin on Fri Dec 15 21:31:54 GMT 2023 , Edited by admin on Fri Dec 15 21:31:54 GMT 2023
PRIMARY