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Home > Thiazole > 1566683-19-9
1566683-19-9 | 4-METHYL-5-(1,3-THIAZOL-4-YL)-4H-1,2,4-TRIAZOLE-3-SULFONYL CHLORIDE
CAS No: 1566683-19-9 Catalog No: AG01B3LF MDL No:MFCD26089820
Product Description
Catalog Number:
AG01B3LF
Chemical Name:
4-METHYL-5-(1,3-THIAZOL-4-YL)-4H-1,2,4-TRIAZOLE-3-SULFONYL CHLORIDE
CAS Number:
1566683-19-9
Molecular Formula:
C6H5ClN4O2S2
Molecular Weight:
264.7125
MDL Number:
MFCD26089820
IUPAC Name:
4-methyl-5-(1,3-thiazol-4-yl)-1,2,4-triazole-3-sulfonyl chloride
InChI:
InChI=1S/C6H5ClN4O2S2/c1-11-5(4-2-14-3-8-4)9-10-6(11)15(7,12)13/h2-3H,1H3
InChI Key:
PIGIOIWBUTTZFW-UHFFFAOYSA-N
SMILES:
Cn1c(nnc1S(=O)(=O)Cl)c1cscn1
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.954g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.702g/mol
Monoisotopic Mass:
263.954g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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