CAS: 69009-29-6
الاسم: 3-methylbut-1-en-1-one
SMILES:
CC(C)C=C=OMolecular Processing
Molecular formula
C5H8O
Molecular weight
84.12
Exact mass
84.0575
XLogP
1.03
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
25.1
Supplementary Information
InChIKey: OXCVCJVUOYADBS-UHFFFAOYSA-N
مرادفات
3-Methylbut-1-en-1-one69009-29-6DTXSID40596073RefChem:281059DTXCID302115863-methylbut-1-en-1-alSCHEMBL295496SCHEMBL4834424SCHEMBL11664578SCHEMBL16671587SCHEMBL17556608OXCVCJVUOYADBS-UHFFFAOYSA-N
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