Benzenesulfonyl chloride, 4-(1-methylethyl)-


Chemical Name: Benzenesulfonyl chloride, 4-(1-methylethyl)-
CAS Number: 54997-90-9
Product Number: AG00I9TD(AGN-PC-0KK6SL)
Synonyms:
MDL No: MFCD00041510
Molecular Formula: C9H11ClO2S
Molecular Weight: 218.7004

Identification/Properties


Properties
MP:
51-52℃
BP:
282.6 °C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
218.695g/mol
XLogP3:
3.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
218.017g/mol
Monoisotopic Mass:
218.017g/mol
Topological Polar Surface Area:
42.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
245
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3265
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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