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The molecular formula of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is C8H7ClO4S.
The molecular weight of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 234.66 g/mol.
The IUPAC name of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 2-chloro-5-methylsulfonylbenzoic acid.
The InChIKey of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is SKWDIXBVQATQSG-UHFFFAOYSA-N.
The Canonical SMILES of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is CS(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)O.
The CAS number of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 89938-62-5.
The XLogP3 value of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 1.4.
The hydrogen bond donor count of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 1.
The topological polar surface area of 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is 79.8 Å2.
Yes, 2-CHLORO-5-(METHYLSULFONYL)BENZOIC ACID is a canonicalized compound.
89937-81-5
89938-07-8
89938-16-9
89939-20-8
89939-60-6
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