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179687-79-7 | Pyridine, 2-[(2-chloro-4-nitrophenoxy)methyl]-
CAS No: 179687-79-7 Catalog No: AG002777 MDL No:MFCD09380073
Product Description
Catalog Number:
AG002777
Chemical Name:
Pyridine, 2-[(2-chloro-4-nitrophenoxy)methyl]-
CAS Number:
179687-79-7
Molecular Formula:
C12H9ClN2O3
Molecular Weight:
264.6645
MDL Number:
MFCD09380073
IUPAC Name:
2-[(2-chloro-4-nitrophenoxy)methyl]pyridine
InChI:
InChI=1S/C12H9ClN2O3/c13-11-7-10(15(16)17)4-5-12(11)18-8-9-3-1-2-6-14-9/h1-7H,8H2
InChI Key:
GWYKHOLLVPAQFF-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1OCc1ccccn1)[N+](=O)[O-]
EC Number:
605-865-3
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.03g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.665g/mol
Monoisotopic Mass:
264.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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