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Home > Pyridines > 1261895-73-1
1261895-73-1 | Benzoic acid, 4-(5-hydroxy-3-pyridinyl)-
CAS No: 1261895-73-1 Catalog No: AG000S3W MDL No:MFCD18312125
Product Description
Catalog Number:
AG000S3W
Chemical Name:
Benzoic acid, 4-(5-hydroxy-3-pyridinyl)-
CAS Number:
1261895-73-1
Molecular Formula:
C12H9NO3
Molecular Weight:
215.2048
MDL Number:
MFCD18312125
IUPAC Name:
4-(5-hydroxypyridin-3-yl)benzoic acid
InChI:
InChI=1S/C12H9NO3/c14-11-5-10(6-13-7-11)8-1-3-9(4-2-8)12(15)16/h1-7,14H,(H,15,16)
InChI Key:
NRHIOPUVWLLSIS-UHFFFAOYSA-N
SMILES:
Oc1cncc(c1)c1ccc(cc1)C(=O)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.058g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
215.208g/mol
Monoisotopic Mass:
215.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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