3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one

Modify Date: 2025-09-29 10:04:48

3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one Structure
3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one structure
Common Name 3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one
CAS Number 91167-28-1 Molecular Weight 254.12300
Density N/A Boiling Point N/A
Molecular Formula C11H12BrNO Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C11H12BrNO
Molecular Weight 254.12300
Exact Mass 253.01000
PSA 32.59000
LogP 2.81000
InChIKey OMKOWVBSFUQKIK-UHFFFAOYSA-N
SMILES O=C1Nc2ccccc2CCCC1Br

 Synthetic Route

~51%

3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one Structure

3-bromo-3,4,5,6...

CAS#:91167-28-1

Literature: Watthey; Stanton; Desai; Babiarz; Finn Journal of Medicinal Chemistry, 1985 , vol. 28, # 10 p. 1511 - 1516

~%

3-bromo-3,4,5,6-tetrahydro-1H-1-benzazocin-2-one Structure

3-bromo-3,4,5,6...

CAS#:91167-28-1

Literature: Ciba Geigy Corporation Patent: US4537885 A1, 1985 ;

 Synonyms

3-bromohexahydrobenzoazocin-2-one
3-bromo-3,4,5,6-tetrahydro-1-benzazocin-2-1H-one
1-Benzazocin-2(1H)-one,3-bromo-3,4,5,6-tetrahydro
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