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88347-44-8 | Acetic acid, [(6-phenyl-2-pyridinyl)oxy]-
CAS No: 88347-44-8 Catalog No: AG0045ZM MDL No:
Product Description
Catalog Number:
AG0045ZM
Chemical Name:
Acetic acid, [(6-phenyl-2-pyridinyl)oxy]-
CAS Number:
88347-44-8
Molecular Formula:
C13H11NO3
Molecular Weight:
229.2313
IUPAC Name:
2-(6-phenylpyridin-2-yl)oxyacetic acid
InChI:
InChI=1S/C13H11NO3/c15-13(16)9-17-12-8-4-7-11(14-12)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,16)
InChI Key:
ANQYDYBHUDYDOB-UHFFFAOYSA-N
SMILES:
OC(=O)COc1cccc(n1)c1ccccc1
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:
2.4
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