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89502-03-4 | 4-Thiazolesulfonyl chloride, 5-ethoxy-2-methyl-
CAS No: 89502-03-4 Catalog No: AG0041OS MDL No:
Product Description
Catalog Number:
AG0041OS
Chemical Name:
4-Thiazolesulfonyl chloride, 5-ethoxy-2-methyl-
CAS Number:
89502-03-4
Molecular Formula:
C6H8ClNO3S2
Molecular Weight:
241.7156
IUPAC Name:
5-ethoxy-2-methyl-1,3-thiazole-4-sulfonyl chloride
InChI:
InChI=1S/C6H8ClNO3S2/c1-3-11-6-5(13(7,9)10)8-4(2)12-6/h3H2,1-2H3
InChI Key:
LRUOTUHZPGOBAB-UHFFFAOYSA-N
SMILES:
CCOc1sc(nc1S(=O)(=O)Cl)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.963g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.704g/mol
Monoisotopic Mass:
240.963g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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