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1242336-52-2 | Pyridine, 5-chloro-2-methoxy-3-(phenylmethoxy)-
CAS No: 1242336-52-2 Catalog No: AG000LQO MDL No:MFCD17015842
Product Description
Catalog Number:
AG000LQO
Chemical Name:
Pyridine, 5-chloro-2-methoxy-3-(phenylmethoxy)-
CAS Number:
1242336-52-2
Molecular Formula:
C13H12ClNO2
Molecular Weight:
249.6929
MDL Number:
MFCD17015842
IUPAC Name:
5-chloro-2-methoxy-3-phenylmethoxypyridine
InChI:
InChI=1S/C13H12ClNO2/c1-16-13-12(7-11(14)8-15-13)17-9-10-5-3-2-4-6-10/h2-8H,9H2,1H3
InChI Key:
UMXFFXZBNLBAOS-UHFFFAOYSA-N
SMILES:
COc1ncc(cc1OCc1ccccc1)Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.694g/mol
Monoisotopic Mass:
249.056g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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