(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid

Modify Date: 2024-01-06 15:50:06

(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure
(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid structure
Common Name (3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid
CAS Number 112930-62-8 Molecular Weight 298.35600
Density 1.41g/cm3 Boiling Point 593.3ºC at 760mmHg
Molecular Formula C17H14O3S Melting Point N/A
MSDS N/A Flash Point 312.6ºC

 Names

Name (3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.41g/cm3
Boiling Point 593.3ºC at 760mmHg
Molecular Formula C17H14O3S
Molecular Weight 298.35600
Flash Point 312.6ºC
Exact Mass 298.06600
PSA 73.58000
LogP 4.07990
Vapour Pressure 6.35E-15mmHg at 25°C
Index of Refraction 1.715

 Synthetic Route

~90%

(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure

(3E)-3-(5-oxo-6...

CAS#:112930-62-8

Literature: Polivka, Zdenek; Licha, Irena; Taufmann, Petr; Svatek, Emil; Holubek, Jiri; Protiva, Miroslav Collection of Czechoslovak Chemical Communications, 1987 , vol. 52, # 6 p. 1566 - 1581

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(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure

(3E)-3-(5-oxo-6...

CAS#:112930-62-8

Literature: Ohishi; Hayashida; Mukai; Kimura; Nagahara Chemical and Pharmaceutical Bulletin, 1990 , vol. 38, # 4 p. 1066 - 1068

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(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure

(3E)-3-(5-oxo-6...

CAS#:112930-62-8

Literature: Ohishi; Hayashida; Mukai; Kimura; Nagahara Chemical and Pharmaceutical Bulletin, 1990 , vol. 38, # 4 p. 1066 - 1068

~%

(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure

(3E)-3-(5-oxo-6...

CAS#:112930-62-8

Literature: Polivka, Zdenek; Licha, Irena; Taufmann, Petr; Svatek, Emil; Holubek, Jiri; Protiva, Miroslav Collection of Czechoslovak Chemical Communications, 1987 , vol. 52, # 6 p. 1566 - 1581

~%

(3E)-3-(5-oxo-6H-benzo[c][1]benzothiepin-11-ylidene)propanoic acid Structure

(3E)-3-(5-oxo-6...

CAS#:112930-62-8

Literature: Ohishi; Hayashida; Mukai; Kimura; Nagahara Chemical and Pharmaceutical Bulletin, 1990 , vol. 38, # 4 p. 1066 - 1068

 Synonyms

3-(6,11-dihydrodibenzo<b,e>thiepin-11-ylidene)propionic acid S-oxide
(E)-11-(2-Carboxyethylidene)-6,11-dihydrodibenzo<b,e>thiepin 5-Oxide
Propanoic acid,3-dibenzo(b,e)thiepin-11(6H)-ylidene-,S-oxide,(E)
(E)-3-(6,11-Dihydrodibenzo(b,e)thiepin-11-ylidene)propionic acid S-oxide