Home Halogens Acetamide,2-bromo-2-cyano-

Acetamide,2-bromo-2-cyano-

CAS No.:
1113-55-9
Catalog Number:
AG0082ID
Molecular Formula:
C3H3BrN2O
Molecular Weight:
162.9727
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Product Description
Catalog Number:
AG0082ID
Chemical Name:
Acetamide,2-bromo-2-cyano-
CAS Number:
1113-55-9
Molecular Formula:
C3H3BrN2O
Molecular Weight:
162.9727
MDL Number:
MFCD00182605
IUPAC Name:
2-bromo-2-cyanoacetamide
InChI:
InChI=1S/C3H3BrN2O/c4-2(1-5)3(6)7/h2H,(H2,6,7)
InChI Key:
ABBGMXMPOCXVNL-UHFFFAOYSA-N
SMILES:
NC(=O)C(C#N)Br
NSC Number:
98284
Properties
Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.943g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
162.974g/mol
Monoisotopic Mass:
161.943g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties