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20925-27-3 | Benzonitrile, 4-amino-2-chloro-
CAS No: 20925-27-3 Catalog No: AG002K53 MDL No:MFCD00035926
Product Description
Catalog Number:
AG002K53
Chemical Name:
Benzonitrile, 4-amino-2-chloro-
CAS Number:
20925-27-3
Molecular Formula:
C7H5ClN2
Molecular Weight:
152.5810
MDL Number:
MFCD00035926
IUPAC Name:
4-amino-2-chlorobenzonitrile
InChI:
InChI=1S/C7H5ClN2/c8-7-3-6(10)2-1-5(7)4-9/h1-3H,10H2
InChI Key:
ZFBKYGFPUCUYIF-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1Cl)N
EC Number:
244-114-0
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.014g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.581g/mol
Monoisotopic Mass:
152.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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