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4875-43-8 | 4-(4-METHYLPHENYL)-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE
CAS No: 4875-43-8 Catalog No: AG01AOC8 MDL No:MFCD04971924
Product Description
Catalog Number:
AG01AOC8
Chemical Name:
4-(4-METHYLPHENYL)-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE
CAS Number:
4875-43-8
Molecular Formula:
C13H15N3
Molecular Weight:
213.2783
MDL Number:
MFCD04971924
IUPAC Name:
4-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
InChI:
InChI=1S/C13H15N3/c1-9-2-4-10(5-3-9)12-13-11(6-7-14-12)15-8-16-13/h2-5,8,12,14H,6-7H2,1H3,(H,15,16)
InChI Key:
SVKCSYVDFSFJPN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C1NCCc2c1[nH]cn2
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.127g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.284g/mol
Monoisotopic Mass:
213.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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