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53316-50-0 | 3-(4,5-DIMETHYL-1H-IMIDAZOL-2-YL)-PYRIDINE
CAS No: 53316-50-0 Catalog No: AG01DWHD MDL No:MFCD14583904
Product Description
Catalog Number:
AG01DWHD
Chemical Name:
3-(4,5-DIMETHYL-1H-IMIDAZOL-2-YL)-PYRIDINE
CAS Number:
53316-50-0
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD14583904
IUPAC Name:
3-(4,5-dimethyl-1H-imidazol-2-yl)pyridine
InChI:
InChI=1S/C10H11N3/c1-7-8(2)13-10(12-7)9-4-3-5-11-6-9/h3-6H,1-2H3,(H,12,13)
InChI Key:
YRBOFZKUTHIEBW-UHFFFAOYSA-N
SMILES:
Cc1[nH]c(nc1C)c1cccnc1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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