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1201785-08-1 | 5-Thiazolemethanamine, 2-bromo-, hydrobromide (1:1)
CAS No: 1201785-08-1 Catalog No: AG000QHO MDL No:MFCD09259952
Product Description
Catalog Number:
AG000QHO
Chemical Name:
5-Thiazolemethanamine, 2-bromo-, hydrobromide (1:1)
CAS Number:
1201785-08-1
Molecular Formula:
C4H6Br2N2S
Molecular Weight:
273.9768
MDL Number:
MFCD09259952
IUPAC Name:
(2-bromo-1,3-thiazol-5-yl)methanamine;hydrobromide
InChI:
InChI=1S/C4H5BrN2S.BrH/c5-4-7-2-3(1-6)8-4;/h2H,1,6H2;1H
InChI Key:
VADGHJZAOHIOIY-UHFFFAOYSA-N
SMILES:
NCc1cnc(s1)Br.Br
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:
273.86g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
273.974g/mol
Monoisotopic Mass:
271.862g/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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