Home Halogens chloroacetonitrile

chloroacetonitrile

CAS No.:
107-14-2
Catalog Number:
AG0035VU
Molecular Formula:
C2H2ClN
Molecular Weight:
75.4970
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Product Description
Catalog Number:
AG0035VU
Chemical Name:
chloroacetonitrile
CAS Number:
107-14-2
Molecular Formula:
C2H2ClN
Molecular Weight:
75.4970
MDL Number:
MFCD00001885
IUPAC Name:
2-chloroacetonitrile
InChI:
InChI=1S/C2H2ClN/c3-1-2-4/h1H2
InChI Key:
RENMDAKOXSCIGH-UHFFFAOYSA-N
SMILES:
ClCC#N
EC Number:
203-467-0
UNII:
CN524K9DXD
NSC Number:
6180
RTECS Number:
AL8225000
UN Number:
2668
Properties
Complexity:
41.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
74.988g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
75.495g/mol
Monoisotopic Mass:
74.988g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
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