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132546-81-7 | 3-Pyridinecarboxylic acid, 6-(4-morpholinyl)-, methyl ester
CAS No: 132546-81-7 Catalog No: AG0010TE MDL No:MFCD03783347
Product Description
Catalog Number:
AG0010TE
Chemical Name:
3-Pyridinecarboxylic acid, 6-(4-morpholinyl)-, methyl ester
CAS Number:
132546-81-7
Molecular Formula:
C11H14N2O3
Molecular Weight:
222.2405
MDL Number:
MFCD03783347
IUPAC Name:
methyl 6-morpholin-4-ylpyridine-3-carboxylate
InChI:
InChI=1S/C11H14N2O3/c1-15-11(14)9-2-3-10(12-8-9)13-4-6-16-7-5-13/h2-3,8H,4-7H2,1H3
InChI Key:
FFBPRHFKXVNLDV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1)N1CCOCC1
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.244g/mol
Monoisotopic Mass:
222.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
51.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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