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115919-14-7 | 2-Pyridineacetic acid, α-hydroxy-6-methyl-
CAS No: 115919-14-7 Catalog No: AG000H4L MDL No:
Product Description
Catalog Number:
AG000H4L
Chemical Name:
2-Pyridineacetic acid, α-hydroxy-6-methyl-
CAS Number:
115919-14-7
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
IUPAC Name:
2-hydroxy-2-(6-methylpyridin-2-yl)acetic acid
InChI:
InChI=1S/C8H9NO3/c1-5-3-2-4-6(9-5)7(10)8(11)12/h2-4,7,10H,1H3,(H,11,12)
InChI Key:
SXTABPKZGDVSOE-UHFFFAOYSA-N
SMILES:
Cc1cccc(n1)C(C(=O)O)O
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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