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17385-73-8 | Thiazolo[2,3-b]thiazol-4-ium, 2,3-dihydro-5-methyl-, bromide (1:1)
CAS No: 17385-73-8 Catalog No: AG001Z8J MDL No:
Product Description
Catalog Number:
AG001Z8J
Chemical Name:
Thiazolo[2,3-b]thiazol-4-ium, 2,3-dihydro-5-methyl-, bromide (1:1)
CAS Number:
17385-73-8
Molecular Formula:
C6H8BrNS2
Molecular Weight:
238.1684
IUPAC Name:
5-methyl-2,3-dihydro-[1,3]thiazolo[2,3-b][1,3]thiazol-4-ium;bromide
InChI:
InChI=1S/C6H8NS2.BrH/c1-5-4-9-6-7(5)2-3-8-6;/h4H,2-3H2,1H3;1H/q+1;/p-1
InChI Key:
AXIGPFFJMDTWII-UHFFFAOYSA-M
SMILES:
Cc1csc2[n+]1CCS2.[Br-]
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.928g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.161g/mol
Monoisotopic Mass:
236.928g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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