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1260892-95-2 | 1H-Pyrrole-3-carboxylic acid, 4-(2-pyridinyl)-, methyl ester
CAS No: 1260892-95-2 Catalog No: AG000RJO MDL No:MFCD11976604
Product Description
Catalog Number:
AG000RJO
Chemical Name:
1H-Pyrrole-3-carboxylic acid, 4-(2-pyridinyl)-, methyl ester
CAS Number:
1260892-95-2
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD11976604
IUPAC Name:
methyl 4-pyridin-2-yl-1H-pyrrole-3-carboxylate
InChI:
InChI=1S/C11H10N2O2/c1-15-11(14)9-7-12-6-8(9)10-4-2-3-5-13-10/h2-7,12H,1H3
InChI Key:
GYZVVQHDGNCEFI-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]cc1c1ccccn1
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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