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81320-42-5

81320-42-5 structure
81320-42-5 structure
  • Name: (+-)-N-t-Butyl-11H-dibenzo(b,e)(1,4)dioxepin-11-ethanamine fumarate
  • Chemical Name: N-[2-(11H-Dibenzo[b,e][1,4]dioxepin-11-yl)ethyl]-2-methyl-2-propa namine (2E)-2-butenedioate (1:1)
  • CAS Number: 81320-42-5
  • Molecular Formula: C23H27NO6
  • Molecular Weight: 413.46400
  • Create Date: 2017-10-07 13:40:37
  • Modify Date: 2024-02-01 18:14:08

Name N-[2-(11H-Dibenzo[b,e][1,4]dioxepin-11-yl)ethyl]-2-methyl-2-propa namine (2E)-2-butenedioate (1:1)
Boiling Point 397.3ºC at 760 mmHg
Molecular Formula C23H27NO6
Molecular Weight 413.46400
Flash Point 171.7ºC
Exact Mass 413.18400
PSA 105.09000
LogP 4.79330

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HP3082325
CAS REGISTRY NUMBER :
81320-42-5
LAST UPDATED :
199703
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C19-H23-N-O2.C4-H4-O4
MOLECULAR WEIGHT :
413.51

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRXXBL French Demande Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2480283
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
80 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRXXBL French Demande Patent Document. (U.S. Patent and Trademark Office, Foreign Patents, Washington, DC 20231) Volume(issue)/page/year: #2480283