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893740-67-5 | 5-(3-(Benzyloxy);phenyl);nicotinic acid
CAS No: 893740-67-5 Catalog No: AG003WGD MDL No:MFCD06802764
Product Description
Catalog Number:
AG003WGD
Chemical Name:
5-(3-(Benzyloxy);phenyl);nicotinic acid
CAS Number:
893740-67-5
Molecular Formula:
C19H15NO3
Molecular Weight:
305.3273
MDL Number:
MFCD06802764
IUPAC Name:
5-(3-phenylmethoxyphenyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C19H15NO3/c21-19(22)17-9-16(11-20-12-17)15-7-4-8-18(10-15)23-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,21,22)
InChI Key:
ZGYYOXUXEQFTPJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)c1cccc(c1)OCc1ccccc1
Properties
Complexity:
381
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.105g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
305.333g/mol
Monoisotopic Mass:
305.105g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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