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159539-19-2

159539-19-2 | Benzenesulfonyl chloride, 2,4,6-tris(1,1-dimethylethyl)-

CAS No: 159539-19-2 Catalog No: AG001R60 MDL No:

Product Description

Catalog Number:
AG001R60
Chemical Name:
Benzenesulfonyl chloride, 2,4,6-tris(1,1-dimethylethyl)-
CAS Number:
159539-19-2
Molecular Formula:
C18H29ClO2S
Molecular Weight:
344.9397
IUPAC Name:
2,4,6-tritert-butylbenzenesulfonyl chloride
InChI:
InChI=1S/C18H29ClO2S/c1-16(2,3)12-10-13(17(4,5)6)15(22(19,20)21)14(11-12)18(7,8)9/h10-11H,1-9H3
InChI Key:
JZPLWPVRNMDUHS-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1S(=O)(=O)Cl)C(C)(C)C)C(C)(C)C)(C)C

Properties

Complexity:
459  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.158g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.938g/mol
Monoisotopic Mass:
344.158g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7  

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