CAS
26016-99-9 Purity
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26016-99-9 Purity
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Benzo[b]thiophene-2-carboxylic acid, 6-chloro-
CAS
26018-73-5
Catalog Number
ACM26018735
Category
Other Products
Molecular Weight
212.66
Molecular Formula
C9H5ClO2S
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- Product Description
- Case Study
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- Synthetic Use
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Specification
Synonyms
6-Chlorobenzo[b]thiophene-2-carboxylic acid, 26018-73-5, 6-chloro-1-benzothiophene-2-carboxylic acid, SureCN156320, AC1OG6B7, CTK1A1268, MolPort-001-757-786, SBB094712, AKOS005072648, AG-C-08219, GA-0945, MCULE-2203734746, RP12360, AK120891, KB-84233, FT-0681062, Benzo[b]thiophene-2-carboxylic acid, 6-chloro-, I01-14376, 2-Carboxy-6-chlorobenzo[b]thiophene;6-Chlorobenzo[b]thiophene-2-carboxylic acid;
IUPAC Name
6-chloro-1-benzothiophene-2-carboxylic acid
Canonical SMILES
C1=CC2=C(C=C1Cl)SC(=C2)C(=O)O
InChI Key
AVAGKGZNBMZOLD-UHFFFAOYSA-N
Boiling Point
408.6ºC at 760 mmHg
Melting Point
271-274ºC
Flash Point
200.9ºC
Density
1.546g/cm³
Exact Mass
211.97000
Hazard Statements
Xi
H-Bond Acceptor
3
H-Bond Donor
1
Upstream Synthesis Route 1
- 104795-85-9
- 26018-73-5
Reference: [1] Patent: US2007/185113, 2007, A1, . Location in patent: Page/Page column 13
Upstream Synthesis Route 2
- 105191-53-5
- 26018-73-5
Reference: [1] Patent: WO2018/122232, 2018, A1, . Location in patent: Page/Page column 245; 246
Upstream Synthesis Route 3
- 61072-56-8
- 26018-73-5
Reference: [1] Patent: WO2015/42397, 2015, A1,
Downstream Synthesis Route 1
- 26018-73-5
- 105191-51-3
Reference: [1]Liebigs Annalen der Chemie,1986,p. 438 - 455
[2]Journal of Medicinal Chemistry,2007,vol. 50,p. 4793 - 4807
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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