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159153-42-1 | Pyridine, 2-chloro-5-[(1E)-2-nitroethenyl]-
CAS No: 159153-42-1 Catalog No: AG001QJA MDL No:
Product Description
Catalog Number:
AG001QJA
Chemical Name:
Pyridine, 2-chloro-5-[(1E)-2-nitroethenyl]-
CAS Number:
159153-42-1
Molecular Formula:
C7H5ClN2O2
Molecular Weight:
184.5798
IUPAC Name:
2-chloro-5-(2-nitroethenyl)pyridine
InChI:
InChI=1S/C7H5ClN2O2/c8-7-2-1-6(5-9-7)3-4-10(11)12/h1-5H
InChI Key:
GZEJYDYASHTDOU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)/C=C/c1ccc(nc1)Cl
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.579g/mol
Monoisotopic Mass:
184.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
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