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902130-87-4 | 6-Methoxy-3-pyridineacetic Acid
CAS No: 902130-87-4 Catalog No: AG003N9M MDL No:MFCD09924951
Product Description
Catalog Number:
AG003N9M
Chemical Name:
6-Methoxy-3-pyridineacetic Acid
CAS Number:
902130-87-4
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD09924951
IUPAC Name:
2-(6-methoxypyridin-3-yl)acetic acid
InChI:
InChI=1S/C8H9NO3/c1-12-7-3-2-6(5-9-7)4-8(10)11/h2-3,5H,4H2,1H3,(H,10,11)
InChI Key:
UTQOMFXXEDWGIQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cn1)CC(=O)O
Properties
Complexity:
160
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:
1
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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