53553-05-2
2,6-DICHLORO-3-CHLOROSULFONYL-BENZOIC ACID
Name
2,6-DICHLORO-3-CHLOROSULFONYL-BENZOIC ACID
Formula
C7 H3 Cl3 O4 S
MolWeight
289.522
1Identification
【Name】
2,6-DICHLORO-3-CHLOROSULFONYL-BENZOIC ACID
【CAS】
【MDL】
MFCD06660592
【English Synonyms】
【Formula】
C7 H3 Cl3 O4 S
【MolWeight】
289.522
【Inchi】
InChI=1S/C7H3Cl3O4S/c8-3-1-2-4(15(10,13)14)6(9)5(3)7(11)12/h1-2H,(H,11,12)
【InChIKey】
InChIKey=RVCLISIPGZGQPU-UHFFFAOYSA-N
【SMILES】
c1cc(c(c(c1S(=O)(=O)Cl)Cl)C(=O)O)Cl
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,6-DICHLORO-3-CHLOROSULFONYL-BENZOIC ACID.cml
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