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1009069-83-3 | 2-Pyridinamine, 3-bromo-N-[(4-methoxyphenyl)methyl]-
CAS No: 1009069-83-3 Catalog No: AG000351 MDL No:MFCD16382740
Product Description
Catalog Number:
AG000351
Chemical Name:
2-Pyridinamine, 3-bromo-N-[(4-methoxyphenyl)methyl]-
CAS Number:
1009069-83-3
Molecular Formula:
C13H13BrN2O
Molecular Weight:
293.1591
MDL Number:
MFCD16382740
IUPAC Name:
3-bromo-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
InChI:
InChI=1S/C13H13BrN2O/c1-17-11-6-4-10(5-7-11)9-16-13-12(14)3-2-8-15-13/h2-8H,9H2,1H3,(H,15,16)
InChI Key:
MVIMDOOGCSXGFK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CNc1ncccc1Br
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.021g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.164g/mol
Monoisotopic Mass:
292.021g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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