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34662-24-3 | 2-Chloro-3-nitrobenzonitrile
CAS No: 34662-24-3 Catalog No: AG003GW0 MDL No:MFCD11044838
Product Description
Catalog Number:
AG003GW0
Chemical Name:
2-Chloro-3-nitrobenzonitrile
CAS Number:
34662-24-3
Molecular Formula:
C7H3ClN2O2
Molecular Weight:
182.5639
MDL Number:
MFCD11044838
IUPAC Name:
2-chloro-3-nitrobenzonitrile
InChI:
InChI=1S/C7H3ClN2O2/c8-7-5(4-9)2-1-3-6(7)10(11)12/h1-3H
InChI Key:
AGZYMTWFJLEBIJ-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1Cl)[N+](=O)[O-]
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.988g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.563g/mol
Monoisotopic Mass:
181.988g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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