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1315366-18-7

1315366-18-7 | 2-(2-methylpropanamido)-1,3-thiazole-5-sulfonyl chloride

CAS No: 1315366-18-7 Catalog No: AG01AJ0B MDL No:MFCD19381989

Product Description

Catalog Number:
AG01AJ0B
Chemical Name:
2-(2-methylpropanamido)-1,3-thiazole-5-sulfonyl chloride
CAS Number:
1315366-18-7
Molecular Formula:
C7H9ClN2O3S2
Molecular Weight:
268.7410
MDL Number:
MFCD19381989
IUPAC Name:
2-(2-methylpropanoylamino)-1,3-thiazole-5-sulfonyl chloride
InChI:
InChI=1S/C7H9ClN2O3S2/c1-4(2)6(11)10-7-9-3-5(14-7)15(8,12)13/h3-4H,1-2H3,(H,9,10,11)
InChI Key:
PZXAQCYNOMYRLQ-UHFFFAOYSA-N
SMILES:
CC(C(=O)Nc1ncc(s1)S(=O)(=O)Cl)C

Properties

Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
268.73g/mol
Monoisotopic Mass:
267.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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