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Home > Encyclopedia > 6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech.

6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech.

6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech. structure

6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech. 

structure
  • CAS No:

    172516-41-5

  • Formula:

    C12H14O3S2

  • Chemical Name:

    6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech.

  • Synonyms:

    6,6-dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetrahydrobenzo[c]thiophene-1-carboxylic acid;6,6-Dimethyl-3-(methylthio)-4-oxo-4,5,6,7-tetra-hydrobenzo[c]thiophene-1-carboxylic acid;SBB053495;6,6-dimethyl-3-methylsulfanyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid;6,6-dimethyl-3-(methylthio)-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid;Benzo[c]thiophene-1-carboxylicacid, 4,5,6,7-tetrahydro-6,6-dimethyl-3-(methylthio)-4-oxo-;MLS001060791;SCHEMBL4401833;CHEMBL2141310;CHEBI:93049

Description

6,6-dimethyl-3-(methylthio)-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid is a thiophenecarboxylic acid.

6,6-Dimethyl-3-(methylthio)-4,5,6,7-tetrahydrobenzo[c]thiophen-4-oxo-1-carboxylic acid, tech. Basic Attributes

270.37

270.038

DTXSID60384833

2934999090

Characteristics

108

3.2

Safety Information

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302

Computed Properties

Molecular Weight:270.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:270.03843665
Monoisotopic Mass:270.03843665
Topological Polar Surface Area:108
Heavy Atom Count:17
Complexity:354
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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