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1823931-67-4

1823931-67-4 | (2-tert-butyl-1,3-thiazol-4-yl)methanesulfonyl chloride

CAS No: 1823931-67-4 Catalog No: AG01BEPT MDL No:MFCD28064105

Product Description

Catalog Number:
AG01BEPT
Chemical Name:
(2-tert-butyl-1,3-thiazol-4-yl)methanesulfonyl chloride
CAS Number:
1823931-67-4
Molecular Formula:
C8H12ClNO2S2
Molecular Weight:
253.7694
MDL Number:
MFCD28064105
IUPAC Name:
(2-tert-butyl-1,3-thiazol-4-yl)methanesulfonyl chloride
InChI:
InChI=1S/C8H12ClNO2S2/c1-8(2,3)7-10-6(4-13-7)5-14(9,11)12/h4H,5H2,1-3H3
InChI Key:
AKBKTSJZVGKRTE-UHFFFAOYSA-N
SMILES:
CC(c1scc(n1)CS(=O)(=O)Cl)(C)C

Properties

Complexity:
291  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.759g/mol
Monoisotopic Mass:
253g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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