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1414958-88-5 | 2-Thiazolemethanamine, 5-bromo-, hydrochloride (1:1)
CAS No: 1414958-88-5 Catalog No: AG001GH0 MDL No:MFCD22689362
Product Description
Catalog Number:
AG001GH0
Chemical Name:
2-Thiazolemethanamine, 5-bromo-, hydrochloride (1:1)
CAS Number:
1414958-88-5
Molecular Formula:
C4H6BrClN2S
Molecular Weight:
229.5258
MDL Number:
MFCD22689362
IUPAC Name:
(5-bromo-1,3-thiazol-2-yl)methanamine;hydrochloride
InChI:
InChI=1S/C4H5BrN2S.ClH/c5-3-2-7-4(1-6)8-3;/h2H,1,6H2;1H
InChI Key:
LLSQJRJUBNDTTK-UHFFFAOYSA-N
SMILES:
NCc1ncc(s1)Br.Cl
Properties
Complexity:
80.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.912g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
229.52g/mol
Monoisotopic Mass:
227.912g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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