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78815-49-3 | (3-methoxyphenyl)(pyridin-4-yl)methanol
CAS No: 78815-49-3 Catalog No: AG01A5SL MDL No:MFCD12153559
Product Description
Catalog Number:
AG01A5SL
Chemical Name:
(3-methoxyphenyl)(pyridin-4-yl)methanol
CAS Number:
78815-49-3
Molecular Formula:
C13H13NO2
Molecular Weight:
215.2478
MDL Number:
MFCD12153559
IUPAC Name:
(3-methoxyphenyl)-pyridin-4-ylmethanol
InChI:
InChI=1S/C13H13NO2/c1-16-12-4-2-3-11(9-12)13(15)10-5-7-14-8-6-10/h2-9,13,15H,1H3
InChI Key:
NQSVTSGCCQLKHQ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C(c1ccncc1)O
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.095g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.252g/mol
Monoisotopic Mass:
215.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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