2-Methoxy-4,5-dimethylbenzene-1-sulfonyl chloride


Chemical Name: 2-Methoxy-4,5-dimethylbenzene-1-sulfonyl chloride
CAS Number: 90416-52-7
Product Number: AG00GVS2(AGN-PC-0WB5TL)
Synonyms:
MDL No: MFCD08443668
Molecular Formula: C9H11ClO3S
Molecular Weight: 234.6998

Identification/Properties


Computed Properties
Molecular Weight:
234.694g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
234.012g/mol
Monoisotopic Mass:
234.012g/mol
Topological Polar Surface Area:
51.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
283
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:
P260-P280-P303+P361+P353-P301+P330+P331-P304+P340+P310-P305+P351+P338+P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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