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Home > Imidazoles > 1378814-75-5
1378814-75-5 | 2-CARBETHOXY-1H-IMIDAZO[4,5-C]PIPERIDINE
CAS No: 1378814-75-5 Catalog No: AG01C9PG MDL No:MFCD14636112
Product Description
Catalog Number:
AG01C9PG
Chemical Name:
2-CARBETHOXY-1H-IMIDAZO[4,5-C]PIPERIDINE
CAS Number:
1378814-75-5
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
MDL Number:
MFCD14636112
IUPAC Name:
ethyl 3H-imidazo[4,5-c]pyridine-2-carboxylate
InChI:
InChI=1S/C9H9N3O2/c1-2-14-9(13)8-11-6-3-4-10-5-7(6)12-8/h3-5H,2H2,1H3,(H,11,12)
InChI Key:
IRKUAHWNUMPODE-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc2c([nH]1)CCNC2
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.069g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.19g/mol
Monoisotopic Mass:
191.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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