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Structure

3-Chloro-6-methylbenzo(b)thiophene-2-ca&

CAS
34576-96-0
Catalog Number
ACM34576960
Category
Other Products
Molecular Weight
226.68
Molecular Formula
C10H7ClO2S

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Specification

Synonyms
3-chloro-6-methyl-1-benzothiophene-2-carboxylic acid, 3-Chloro-6-methylbenzo[b]thiophene-2-carboxylic acid, 34576-96-0, CHEMBL2314523, 3-Chloro-6-methyl-benzo[b]thiophene-2-carboxylic acid, BAS 01213367, ACMC-20an6a, AC1Q3LGR, CBMicro_023300, SureCN417349, AC1LG5P5, AC1Q2O1Q, 646814_ALDRICH, CTK1C0981, MolPort-000-499-463, ACT07951, ALBB-000953, AR-1F2657, BBL013609, CCG-10571
IUPAC Name
3-chloro-6-methyl-1-benzothiophene-2-carboxylic acid
Canonical SMILES
CC1=CC2=C(C=C1)C(=C(S2)C(=O)O)Cl
InChI Key
KWGVHWHFCFSQAZ-UHFFFAOYSA-N
Boiling Point
405.5ºC at 760 mmHg
Melting Point
271-275ºC(lit.)
Flash Point
199ºC
Density
1.474g/cm³
Exact Mass
225.98600
H-Bond Acceptor
3
H-Bond Donor
1
WGK Germany
3

Downstream Synthesis Route 1

  • 34576-96-0
  • 7440-44-0
  • 1467-86-3

Reference: [1] Patent: US2012/65370, 2012, A1,

Downstream Synthesis Route 2

  • 34576-96-0
  • 1467-86-3

Reference: [1] Patent: WO2010/133306, 2010, A1, . Location in patent: Page/Page column 9; 24; 25

Downstream Synthesis Route 3

  • 34576-96-0
  • 7440-44-0
  • 7440-05-3
  • 1467-86-3

Reference: [1] Patent: US2012/65370, 2012, A1,

Downstream Synthesis Route 4

  • 34576-96-0
  • 1467-86-3

Reference: [1]Patent: WO2010/133306,2010,A1 .Location in patent: Page/Page column 9; 24; 25

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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