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144772-39-4 | Acetonitrile, 2,2-dibromo-2-chloro-
CAS No: 144772-39-4 Catalog No: AG001K55 MDL No:MFCD18379352
Product Description
Catalog Number:
AG001K55
Chemical Name:
Acetonitrile, 2,2-dibromo-2-chloro-
CAS Number:
144772-39-4
Molecular Formula:
C2Br2ClN
Molecular Weight:
233.2891
MDL Number:
MFCD18379352
IUPAC Name:
2,2-dibromo-2-chloroacetonitrile
InChI:
InChI=1S/C2Br2ClN/c3-2(4,5)1-6
InChI Key:
RARYQRXQKOVEPM-UHFFFAOYSA-N
SMILES:
N#CC(Br)(Br)Cl
Properties
Complexity:
91
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.807g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.287g/mol
Monoisotopic Mass:
230.809g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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