(5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate

Modify Date: 2025-08-25 10:16:49

(5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate Structure
(5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate structure
Common Name (5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate
CAS Number 89650-00-0 Molecular Weight 310.36700
Density N/A Boiling Point N/A
Molecular Formula C18H14O3S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name (5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate

 Chemical & Physical Properties

Molecular Formula C18H14O3S
Molecular Weight 310.36700
Exact Mass 310.06600
PSA 68.67000
LogP 4.10600
InChIKey CPVWXKWSHQGEDJ-UHFFFAOYSA-N
SMILES O=C(OC=C1CCSc2ccccc2C1=O)c1ccccc1

 Synthetic Route

~76%

(5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate Structure

(5-oxo-2,3-dihy...

CAS#:89650-00-0

Literature: Bhattacharya, Sudin; Mandal, Asok N.; Chaudhuri, Swadesh R. Ray; Chatterjee, Amareshwar Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984 , # 1 p. 5 - 13

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(5-oxo-2,3-dihydro-1-benzothiepin-4-ylidene)methyl benzoate Structure

(5-oxo-2,3-dihy...

CAS#:89650-00-0

Literature: Bhattacharya, Sudin; Mandal, Asok N.; Chaudhuri, Swadesh R. Ray; Chatterjee, Amareshwar Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1984 , # 1 p. 5 - 13
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