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117382-43-1 | 2-Pyridinamine, N-[(4-bromophenyl)methyl]-
CAS No: 117382-43-1 Catalog No: AG000E70 MDL No:
Product Description
Catalog Number:
AG000E70
Chemical Name:
2-Pyridinamine, N-[(4-bromophenyl)methyl]-
CAS Number:
117382-43-1
Molecular Formula:
C12H11BrN2
Molecular Weight:
263.1331
IUPAC Name:
N-[(4-bromophenyl)methyl]pyridin-2-amine
InChI:
InChI=1S/C12H11BrN2/c13-11-6-4-10(5-7-11)9-15-12-3-1-2-8-14-12/h1-8H,9H2,(H,14,15)
InChI Key:
MBJGVIVWYUXRQP-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)CNc1ccccn1
Properties
Complexity:
179
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.011g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.138g/mol
Monoisotopic Mass:
262.011g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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