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Home > Thiazole > 1355334-86-9
1355334-86-9 | 3-METHYL-ISOTHIAZOLE-5-SULFONYL CHLORIDE
CAS No: 1355334-86-9 Catalog No: AG01BET5 MDL No:MFCD21362487
Product Description
Catalog Number:
AG01BET5
Chemical Name:
3-METHYL-ISOTHIAZOLE-5-SULFONYL CHLORIDE
CAS Number:
1355334-86-9
Molecular Formula:
C4H4ClNO2S2
Molecular Weight:
197.6631
MDL Number:
MFCD21362487
IUPAC Name:
3-methyl-1,2-thiazole-5-sulfonyl chloride
InChI:
InChI=1S/C4H4ClNO2S2/c1-3-2-4(9-6-3)10(5,7)8/h2H,1H3
InChI Key:
LJTRGHGACFEWIM-UHFFFAOYSA-N
SMILES:
Cc1nsc(c1)S(=O)(=O)Cl
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.937g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.651g/mol
Monoisotopic Mass:
196.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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