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136117-69-6 | Methyl imidazo[1,2-a]pyridine-6-carboxylate
CAS No: 136117-69-6 Catalog No: AG003S0I MDL No:MFCD06200984
Product Description
Catalog Number:
AG003S0I
Chemical Name:
Methyl imidazo[1,2-a]pyridine-6-carboxylate
CAS Number:
136117-69-6
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
MDL Number:
MFCD06200984
IUPAC Name:
methyl imidazo[1,2-a]pyridine-6-carboxylate
InChI:
InChI=1S/C9H8N2O2/c1-13-9(12)7-2-3-8-10-4-5-11(8)6-7/h2-6H,1H3
InChI Key:
BTDBMFODXFTFIL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2n(c1)ccn2
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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