8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid

Modify Date: 2025-08-26 00:38:26

8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid Structure
8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid structure
Common Name 8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid
CAS Number 823225-86-1 Molecular Weight 233.22000
Density N/A Boiling Point N/A
Molecular Formula C12H11NO4 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C12H11NO4
Molecular Weight 233.22000
Exact Mass 233.06900
PSA 79.55000
LogP 1.61218

 Synthetic Route

~%

8-(cyanomethyl)-3,4-dihydro-2H-1,5-benzodioxepine-6-carboxylic acid Structure

8-(cyanomethyl)...

CAS#:823225-86-1

Literature: JANSSEN PHARMACEUTICA N.V. Patent: WO2005/838 A1, 2005 ; Location in patent: Page 30 ; WO 2005/000838 A1

 Precursor & DownStream

Precursor  1

DownStream  0

 Synonyms

2H-1,5-Benzodioxepin-6-carboxylic acid,8-(cyanomethyl)-3,4-dihydro
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