CAS: 598-31-2
이름: 1-bromopropan-2-one
SMILES:
CC(=O)CBrMolecular Processing
Molecular formula
C3H5BrO
Molecular weight
136.98
Exact mass
135.9524
XLogP
0.97
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
5
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
24.47
Supplementary Information
InChIKey: VQFAIAKCILWQPZ-UHFFFAOYSA-N
동의어
BROMOACETONE598-31-21-Bromo-2-propanone1-bromopropan-2-oneMonobromoacetone1-BromoacetoneAcetonyl bromideMartonite2-Propanone, 1-bromo-Bromo-2-propanoneBromomethyl methyl ketoneB-StoffAcetylmethyl bromideAcetyl methyl bromide2-Propanone, bromo-alpha-BromoacetoneBA (tear gas)3O8L0EWR5QDTXSID6060507CHEBI:51845RefChem:570320DTXCID9042700209-928-2bromopropanonebromo acetone1-bromo-propan-2-oneRCRA waste number P017.alpha.-BromoacetoneCHEMBL1085947HSDB 315
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