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89501-99-5 | 4-Thiazolesulfonyl chloride
CAS No: 89501-99-5 Catalog No: AG0041UG MDL No:MFCD19200975
Product Description
Catalog Number:
AG0041UG
Chemical Name:
4-Thiazolesulfonyl chloride
CAS Number:
89501-99-5
Molecular Formula:
C3H2ClNO2S2
Molecular Weight:
183.6365
MDL Number:
MFCD19200975
IUPAC Name:
1,3-thiazole-4-sulfonyl chloride
InChI:
InChI=1S/C3H2ClNO2S2/c4-9(6,7)3-1-8-2-5-3/h1-2H
InChI Key:
QBBJFQBYISAYRW-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)c1ncsc1
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.922g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.624g/mol
Monoisotopic Mass:
182.922g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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