Home Sulfos 2-methoxy-3,5-dimethylbenzene-1-sulfonyl chloride

2-methoxy-3,5-dimethylbenzene-1-sulfonyl chloride

CAS No.:
749268-53-9
Catalog Number:
AG01B7N6
Molecular Formula:
C9H11ClO3S
Molecular Weight:
234.6998
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Product Description
Catalog Number:
AG01B7N6
Chemical Name:
2-methoxy-3,5-dimethylbenzene-1-sulfonyl chloride
CAS Number:
749268-53-9
Molecular Formula:
C9H11ClO3S
Molecular Weight:
234.6998
MDL Number:
MFCD10485861
IUPAC Name:
2-methoxy-3,5-dimethylbenzenesulfonyl chloride
InChI:
InChI=1S/C9H11ClO3S/c1-6-4-7(2)9(13-3)8(5-6)14(10,11)12/h4-5H,1-3H3
InChI Key:
CRGHFEWSHJGVJX-UHFFFAOYSA-N
SMILES:
COc1c(C)cc(cc1S(=O)(=O)Cl)C
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.012g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.694g/mol
Monoisotopic Mass:
234.012g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties