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1260180-20-8 | 3-Pyridinemethanamine, 5-(4-chlorophenyl)-
CAS No: 1260180-20-8 Catalog No: AG000QR3 MDL No:MFCD19688869
Product Description
Catalog Number:
AG000QR3
Chemical Name:
3-Pyridinemethanamine, 5-(4-chlorophenyl)-
CAS Number:
1260180-20-8
Molecular Formula:
C12H11ClN2
Molecular Weight:
218.6821
MDL Number:
MFCD19688869
IUPAC Name:
[5-(4-chlorophenyl)pyridin-3-yl]methanamine
InChI:
InChI=1S/C12H11ClN2/c13-12-3-1-10(2-4-12)11-5-9(6-14)7-15-8-11/h1-5,7-8H,6,14H2
InChI Key:
KHKZPUDQLZYPFB-UHFFFAOYSA-N
SMILES:
NCc1cncc(c1)c1ccc(cc1)Cl
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.061g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.684g/mol
Monoisotopic Mass:
218.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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