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783300-26-5 | 2-Phenyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CAS No: 783300-26-5 Catalog No: AG008MZU MDL No:
Product Description
Catalog Number:
AG008MZU
Chemical Name:
2-Phenyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
CAS Number:
783300-26-5
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
IUPAC Name:
2-phenyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
InChI:
InChI=1S/C12H13N3/c1-2-4-9(5-3-1)12-14-10-6-7-13-8-11(10)15-12/h1-5,13H,6-8H2,(H,14,15)
InChI Key:
QTCSWUNYWAOZHC-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nc2c([nH]1)CNCC2
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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