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69812-30-2 | 2-Acetamidothiazole-5-sulfonyl chloride
CAS No: 69812-30-2 Catalog No: AG005HO2 MDL No:MFCD05022486
Product Description
Catalog Number:
AG005HO2
Chemical Name:
2-Acetamidothiazole-5-sulfonyl chloride
CAS Number:
69812-30-2
Molecular Formula:
C5H5ClN2O3S2
Molecular Weight:
240.6878
MDL Number:
MFCD05022486
IUPAC Name:
2-acetamido-1,3-thiazole-5-sulfonyl chloride
InChI:
InChI=1S/C5H5ClN2O3S2/c1-3(9)8-5-7-2-4(12-5)13(6,10)11/h2H,1H3,(H,7,8,9)
InChI Key:
LYOHVKFYBJLEEP-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ncc(s1)S(=O)(=O)Cl
NSC Number:
508982
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.943g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.676g/mol
Monoisotopic Mass:
239.943g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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