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102249-56-9 | 3-Pyridinamine, 2-bromo-5-phenyl-
CAS No: 102249-56-9 Catalog No: AG00070L MDL No:MFCD27939357
Product Description
Catalog Number:
AG00070L
Chemical Name:
3-Pyridinamine, 2-bromo-5-phenyl-
CAS Number:
102249-56-9
Molecular Formula:
C11H9BrN2
Molecular Weight:
249.1066
MDL Number:
MFCD27939357
IUPAC Name:
2-bromo-5-phenylpyridin-3-amine
InChI:
InChI=1S/C11H9BrN2/c12-11-10(13)6-9(7-14-11)8-4-2-1-3-5-8/h1-7H,13H2
InChI Key:
AYGHOJDCYZEXGX-UHFFFAOYSA-N
SMILES:
Brc1ncc(cc1N)c1ccccc1
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.995g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.111g/mol
Monoisotopic Mass:
247.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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