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15084-51-2 | Benzenesulfonyl chloride, 4-(1,1-dimethylethyl)-
CAS No: 15084-51-2 Catalog No: AG001MWP MDL No:MFCD00007449
Product Description
Catalog Number:
AG001MWP
Chemical Name:
Benzenesulfonyl chloride, 4-(1,1-dimethylethyl)-
CAS Number:
15084-51-2
Molecular Formula:
C10H13ClO2S
Molecular Weight:
232.7270
MDL Number:
MFCD00007449
IUPAC Name:
4-tert-butylbenzenesulfonyl chloride
InChI:
InChI=1S/C10H13ClO2S/c1-10(2,3)8-4-6-9(7-5-8)14(11,12)13/h4-7H,1-3H3
InChI Key:
YEZADZMMVHWFIY-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)S(=O)(=O)Cl)(C)C
NSC Number:
186263
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.032g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.722g/mol
Monoisotopic Mass:
232.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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