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114292-91-0 | Pyridinediamine, ar-bromo- (9CI)
CAS No: 114292-91-0 Catalog No: AG000B0C MDL No:MFCD03427651
Product Description
Catalog Number:
AG000B0C
Chemical Name:
Pyridinediamine, ar-bromo- (9CI)
CAS Number:
114292-91-0
Molecular Formula:
C5H6BrN3
Molecular Weight:
188.0252
MDL Number:
MFCD03427651
IUPAC Name:
3-bromopyridine-2,5-diamine
InChI:
InChI=1S/C5H6BrN3/c6-4-1-3(7)2-9-5(4)8/h1-2H,7H2,(H2,8,9)
InChI Key:
YJENCMIONVUOCW-UHFFFAOYSA-N
SMILES:
Nc1cnc(c(c1)Br)N
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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