C(CBr)C(C(=O)Cl)Br
CAS: 82820-87-9
Name: 2,4-dibromobutanoyl chloride
SMILES: C(CBr)C(C(=O)Cl)Br

Molecular Processing

Molecular formula
C4H5Br2ClO
Molecular weight
264.34
Exact mass
261.8396
XLogP
2.3
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
41.99

Supplementary Information

InChIKey: WYZLYWUZERABRL-UHFFFAOYSA-N
Synonyme
2,4-Dibromobutyryl chloride2,4-dibromobutanoyl chloride82820-87-9DTXSID50403002RefChem:443235DTXCID10353857629-640-42,4-dibromobutyrylchlorideMFCD01862994Butanoyl chloride, 2,4-dibromo-2,4-dibromobutanoic acid chlorideC4H5Br2ClO2,4dibromobutyryl chloride2,4 dibromobutanoyl chlorideBrCH2CH2CH(Br)C(O)Cl2,4-dibromo-butyryl chlorideSCHEMBL7890952,4-dibromobutyric acid chlorideWYZLYWUZERABRL-UHFFFAOYSA-NAKOS015898911FD29850MS-20607SY030514DB-023190D875952,4-Dibromobutyryl chloride, technical, ~90% (GC)
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