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1000025-93-3 | 2-Pyridinecarboxylic acid, 3,5-bis(phenylmethoxy)-
CAS No: 1000025-93-3 Catalog No: AG00008R MDL No:MFCD19689666
Product Description
Catalog Number:
AG00008R
Chemical Name:
2-Pyridinecarboxylic acid, 3,5-bis(phenylmethoxy)-
CAS Number:
1000025-93-3
Molecular Formula:
C20H17NO4
Molecular Weight:
335.3533
MDL Number:
MFCD19689666
IUPAC Name:
3,5-bis(phenylmethoxy)pyridine-2-carboxylic acid
InChI:
InChI=1S/C20H17NO4/c22-20(23)19-18(25-14-16-9-5-2-6-10-16)11-17(12-21-19)24-13-15-7-3-1-4-8-15/h1-12H,13-14H2,(H,22,23)
InChI Key:
OEJYKWLDGWAOIF-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(cc1OCc1ccccc1)OCc1ccccc1
Properties
Complexity:
405
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.116g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.359g/mol
Monoisotopic Mass:
335.116g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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