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825643-65-0 | 3-Pyridinamine, 6-chloro-N-methyl-4-(2-methylphenyl)-
CAS No: 825643-65-0 Catalog No: AG004Y3K MDL No:
Product Description
Catalog Number:
AG004Y3K
Chemical Name:
3-Pyridinamine, 6-chloro-N-methyl-4-(2-methylphenyl)-
CAS Number:
825643-65-0
Molecular Formula:
C13H13ClN2
Molecular Weight:
232.7087
IUPAC Name:
6-chloro-N-methyl-4-(2-methylphenyl)pyridin-3-amine
InChI:
InChI=1S/C13H13ClN2/c1-9-5-3-4-6-10(9)11-7-13(14)16-8-12(11)15-2/h3-8,15H,1-2H3
InChI Key:
VTXJZEPMNSPTIC-UHFFFAOYSA-N
SMILES:
CNc1cnc(cc1c1ccccc1C)Cl
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.077g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.711g/mol
Monoisotopic Mass:
232.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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