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16135-36-7 | 3-Pyridinecarboxylic acid, 4-amino-, methyl ester
CAS No: 16135-36-7 Catalog No: AG001SDZ MDL No:MFCD00955996
Product Description
Catalog Number:
AG001SDZ
Chemical Name:
3-Pyridinecarboxylic acid, 4-amino-, methyl ester
CAS Number:
16135-36-7
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD00955996
IUPAC Name:
methyl 4-aminopyridine-3-carboxylate
InChI:
InChI=1S/C7H8N2O2/c1-11-7(10)5-4-9-3-2-6(5)8/h2-4H,1H3,(H2,8,9)
InChI Key:
OCARFFAPQGYGBP-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnccc1N
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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