Home Sulfos 2,3-Dichloro-5-(chlorosulfonyl)benzoic acid

2,3-Dichloro-5-(chlorosulfonyl)benzoic acid

CAS No.:
53552-95-7
Catalog Number:
AG00DBBE
Molecular Formula:
C7H3Cl3O4S
Molecular Weight:
289.5203
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Product Description
Catalog Number:
AG00DBBE
Chemical Name:
2,3-Dichloro-5-(chlorosulfonyl)benzoic acid
CAS Number:
53552-95-7
Molecular Formula:
C7H3Cl3O4S
Molecular Weight:
289.5203
MDL Number:
MFCD09835179
IUPAC Name:
2,3-dichloro-5-chlorosulfonylbenzoic acid
InChI:
InChI=1S/C7H3Cl3O4S/c8-5-2-3(15(10,13)14)1-4(6(5)9)7(11)12/h1-2H,(H,11,12)
InChI Key:
XXGZTPVQCLURSV-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(cc(c1Cl)Cl)S(=O)(=O)Cl
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.882g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.507g/mol
Monoisotopic Mass:
287.882g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties