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Details

Stereochemistry ACHIRAL
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-BUTYLPENTANE-2,4-DIONE

SMILES

CCCCC(C(C)=O)C(C)=O

InChI

InChIKey=MBXOOYPCIDHXGH-UHFFFAOYSA-N
InChI=1S/C9H16O2/c1-4-5-6-9(7(2)10)8(3)11/h9H,4-6H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2221
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 Sat Dec 16 12:32:47 GMT 2023
Edited
by admin
on Sat Dec 16 12:32:47 GMT 2023
Record UNII
6C6N2RN9MM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-BUTYLPENTANE-2,4-DIONE
Systematic Name English
3-BUTYLACETYLACETONE
Common Name English
3-ACETYL-2-HEPTANONE
Common Name English
2,4-PENTANEDIONE, 3-BUTYL-
Systematic Name English
3-BUTYL-2,4-PENTANEDIONE
Systematic Name English
NSC-2249
Code English
3-BUTYLPENTAN-2,4-DIONE
Common Name English
3-(1-BUTYL)-PENTANE-2,4-DIONE
Common Name English
3-N-BUTYL-2,4-PENTANEDIONE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID50165512
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY
ECHA (EC/EINECS)
216-274-1
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY
CAS
1540-36-9
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY
NSC
2249
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY
PUBCHEM
73763
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY
FDA UNII
6C6N2RN9MM
Created by admin on Sat Dec 16 12:32:47 GMT 2023 , Edited by admin on Sat Dec 16 12:32:47 GMT 2023
PRIMARY