CC(=O)CCC(=O)C
CAS: 110-13-4
الاسم: hexane-2,5-dione
SMILES: CC(=O)CCC(=O)C

Molecular Processing

Molecular formula
C6H10O2
Molecular weight
114.14
Exact mass
114.0681
XLogP
0.94
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
30.6

Supplementary Information

InChIKey: OJVAMHKKJGICOG-UHFFFAOYSA-N
مرادفات
2,5-HEXANEDIONEHexane-2,5-dioneAcetonylacetone110-13-41,2-Diacetylethane2,5-DiketohexaneDiacetonyl2,5-HexadioneAcetonyl acetone2,5-Dioxohexanealpha,beta-DiacetylethaneNSC 7621hexanedione, 2,5-DTXSID8030138NSC-7621C0Z8884J3PDTXCID6010138CHEBI:85014acetone, acetonylalpha, beta-diacetylethaneRefChem:83014203-738-3Acetone, acetonyl-2,5-Hexandione.alpha.,.beta.-DiacetylethaneMFCD00008792CH3COCH2CH2COCH3MLS001065580SMR000568468CCRIS 2919
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