4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid

• CAS: 40133-07-1
• Catalog Number: ACM40133071
• Category: Other Products
• Molecular Weight: 182.24
• Molecular Formula: C9H10O2S
• Synonyms: Enamine_001826, Oprea1_686622, MLS000096433, MolPort-000-888-951, STK349487, HMS1399C22, ALBB-000244, SMR000061095, CID2063443, BAS 13134257, 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid, 4,5,6,7-Tetrahydro-benzo[b]thiophene-2-carboxylic acid, 40133-07-1
• IUPAC Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid
• Canonical SMILES: C1CCC2=C(C1)C=C(S2)C(=O)O
• InChI Key: ROLXOQXKNDKXTA-UHFFFAOYSA-N
• Boiling Point: 368.1ºC at 760mmHg
• Flash Point: 176.4ºC
• Exact Mass: 182.04000
• H-Bond Acceptor: 2
• H-Bond Donor: 1

Synthetic Use

Upstream Synthesis Route 1

• 124-38-9
• 13129-17-4

• 40133-07-1

Reference: [1] European Journal of Organic Chemistry, 2000, # 3, p. 425 - 437

Upstream Synthesis Route 2

• 57021-52-0

• 40133-07-1

Reference: [1] Bulletin de la Societe Chimique de France, 1953, p. 62,68, 713, 717
[2] Bulletin de la Societe Chimique de France, 1958, p. 359

Upstream Synthesis Route 3

• 57021-52-0

• 40133-07-1

Reference: [1]Bulletin de la Societe Chimique de France,1953,p. 62,68, 713, 717
[2]Bulletin de la Societe Chimique de France,1958,p. 359

Downstream Synthesis Route 1

• 40133-07-1

• 57021-58-6

Reference: [1] Bulletin de la Societe Chimique de France, 1953, p. 62,68, 713, 717

Downstream Synthesis Route 2

• 40133-07-1

• 57021-58-6

Reference: [1]Bulletin de la Societe Chimique de France,1953,p. 62,68, 713, 717

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