2-(4-methylphenyl)sulfanyl-5-nitrobenzoic acid
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2-(4-methylphenyl)sulfanyl-5-nitrobenzoic acid
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CAS No:
78160-05-1
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Formula:
C14H11NO4S
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Chemical Name:
2-(4-methylphenyl)sulfanyl-5-nitrobenzoic acid
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Synonyms:
5-Nitro-2-p-tolylsulfanyl-benzoic acid; 5-Nitro-2-p-tolylmercapto-benzoesaeure;
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CAS No:
2-(4-methylphenyl)sulfanyl-5-nitrobenzoic acid Basic Attributes
289.30600
289.04087901 g/mol
DTXSID30368549
2930909090
Computed Properties
Molecular Weight:289.31
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:289.04087901
Monoisotopic Mass:289.04087901
Topological Polar Surface Area:108
Heavy Atom Count:20
Complexity:363
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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