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94454-56-5 | 2-Pyridinemethanol, 3-(phenylmethoxy)-, hydrochloride
CAS No: 94454-56-5 Catalog No: AG00H7IC MDL No:
Product Description
Catalog Number:
AG00H7IC
Chemical Name:
2-Pyridinemethanol, 3-(phenylmethoxy)-, hydrochloride
CAS Number:
94454-56-5
Molecular Formula:
C13H14ClNO2
Molecular Weight:
251.7088
IUPAC Name:
(3-phenylmethoxypyridin-2-yl)methanol;hydrochloride
InChI:
InChI=1S/C13H13NO2.ClH/c15-9-12-13(7-4-8-14-12)16-10-11-5-2-1-3-6-11;/h1-8,15H,9-10H2;1H
InChI Key:
KAPQXKINIVWKCX-UHFFFAOYSA-N
SMILES:
OCc1ncccc1OCc1ccccc1.Cl
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.071g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.71g/mol
Monoisotopic Mass:
251.071g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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