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

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

CAS No.:
872277-84-4
Catalog Number:
AG01B7MC
Molecular Formula:
C8H9ClO3S
Molecular Weight:
220.6733
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Product Description
Catalog Number:
AG01B7MC
Chemical Name:
2-hydroxy-3,5-dimethylbenzene-1-sulfonyl chloride
CAS Number:
872277-84-4
Molecular Formula:
C8H9ClO3S
Molecular Weight:
220.6733
MDL Number:
MFCD19200784
IUPAC Name:
2-hydroxy-3,5-dimethylbenzenesulfonyl chloride
InChI:
InChI=1S/C8H9ClO3S/c1-5-3-6(2)8(10)7(4-5)13(9,11)12/h3-4,10H,1-2H3
InChI Key:
VDCHDSXNEUWUGQ-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)S(=O)(=O)Cl)O
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.996g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.667g/mol
Monoisotopic Mass:
219.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties