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1232431-75-2 | 2,3-Pyridinediamine, 4-bromo-
CAS No: 1232431-75-2 Catalog No: AG000K7T MDL No:MFCD15143394
Product Description
Catalog Number:
AG000K7T
Chemical Name:
2,3-Pyridinediamine, 4-bromo-
CAS Number:
1232431-75-2
Molecular Formula:
C5H6BrN3
Molecular Weight:
188.0252
MDL Number:
MFCD15143394
IUPAC Name:
4-bromopyridine-2,3-diamine
InChI:
InChI=1S/C5H6BrN3/c6-3-1-2-9-5(8)4(3)7/h1-2H,7H2,(H2,8,9)
InChI Key:
VDWHUTJUOZXVQW-UHFFFAOYSA-N
SMILES:
Nc1c(Br)ccnc1N
Properties
Complexity:
98.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.975g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
188.028g/mol
Monoisotopic Mass:
186.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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