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1241726-02-2 | 2,4-Pyridinediamine, 5-bromo-, hydrochloride (1:2)
CAS No: 1241726-02-2 Catalog No: AG000LMT MDL No:MFCD17012813
Product Description
Catalog Number:
AG000LMT
Chemical Name:
2,4-Pyridinediamine, 5-bromo-, hydrochloride (1:2)
CAS Number:
1241726-02-2
Molecular Formula:
C5H8BrCl2N3
Molecular Weight:
260.9471
MDL Number:
MFCD17012813
IUPAC Name:
5-bromopyridine-2,4-diamine;dihydrochloride
InChI:
InChI=1S/C5H6BrN3.2ClH/c6-3-2-9-5(8)1-4(3)7;;/h1-2H,(H4,7,8,9);2*1H
InChI Key:
GIGYQORSQKUOOH-UHFFFAOYSA-N
SMILES:
Nc1ncc(c(c1)N)Br.Cl.Cl
Properties
Complexity:
98.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.928g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
260.944g/mol
Monoisotopic Mass:
258.928g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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