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263270-34-4 | 3-Pyridinecarboxylic acid, 5-(phenylmethoxy)-
CAS No: 263270-34-4 Catalog No: AG002SR3 MDL No:
Product Description
Catalog Number:
AG002SR3
Chemical Name:
3-Pyridinecarboxylic acid, 5-(phenylmethoxy)-
CAS Number:
263270-34-4
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
5-phenylmethoxypyridine-3-carboxylic acid
InChI:
InChI=1S/C13H11NO3/c15-13(16)11-6-12(8-14-7-11)17-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,15,16)
InChI Key:
MWWYJDHPRJSMBL-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)OCc1ccccc1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.235g/mol
Monoisotopic Mass:
229.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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