MetaADEDB 2.0 @ LMMD
2,5-hexanedione
(OJVAMHKKJGICOG-UHFFFAOYSA-N)
Structure
SMILES
CC(=O)CCC(=O)C
Molecular Formula:
C6H10O2
Molecular Weight:
114.142
Log P:
0.9446
Hydrogen Bond Acceptor:
2
Hydrogen Bond Donor:
0
TPSA:
34.14
CAS Number(s):
110-13-4
Synonym(s)
1.
2,5-hexanedione
2.
1,2-diacetylethane
3.
2,5-diketohexane
4.
2,5-dioxohexane
5.
NSC-7621
6.
acetone, acetonyl
7.
acetonyl acetone
8.
acetonylacetone
9.
alpha, beta-diacetylethane
10.
diacetonyl
11.
hexanedione, 2,5-
External Link(s)
MeSHC011269
PubChem Compound8035
BindingDB73981
ChEBI85014
CHEMBLCHEMBL1564795
ZINC1683671
Adverse Drug Event(s)
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