8-Methyl-8-azabicyclo[3.2.1]oct-3-yl atropate

Modify Date: 2024-01-12 18:55:39

8-Methyl-8-azabicyclo[3.2.1]oct-3-yl atropate Structure
8-Methyl-8-azabicyclo[3.2.1]oct-3-yl atropate structure
Common Name 8-Methyl-8-azabicyclo[3.2.1]oct-3-yl atropate
CAS Number 500-55-0 Molecular Weight 271.354
Density 1.1±0.1 g/cm3 Boiling Point 389.1±42.0 °C at 760 mmHg
Molecular Formula C17H21NO2 Melting Point N/A
MSDS N/A Flash Point 136.5±18.8 °C

 Names

Name (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenylprop-2-enoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 389.1±42.0 °C at 760 mmHg
Molecular Formula C17H21NO2
Molecular Weight 271.354
Flash Point 136.5±18.8 °C
Exact Mass 271.157227
PSA 29.54000
LogP 3.22
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.572

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YM4025000
CHEMICAL NAME :
1-alpha-H,5-alpha-H-Tropan-3-alpha-ol, atropate (ester)
CAS REGISTRY NUMBER :
500-55-0
BEILSTEIN REFERENCE NO. :
0085429
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C17-H21-N-O2
MOLECULAR WEIGHT :
271.39
WISWESSER LINE NOTATION :
T56 A ANTJ A1 GOVYR&U1

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 :
160 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,117,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10400 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: PB85-203644

 Safety Information

Risk Phrases 26/28
RIDADR UN 1544
HS Code 2933990090

 Synthetic Route

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

Apohyoscyamine
atropic acid tropane-3endo-yl ester
Atropamin
Apoatropin
Atropasaeure-tropan-3endo-ylester
Atropyltropeine
Benzeneacetic acid, α-methylene-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
Propenoic acid, 2-phenyl-, 8-methyl-8-azabicyclo[3.2.1]octan-3-yl ester
8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester
8-Methyl-8-azabicyclo[3.2.1]oct-3-yl atropate
Apohyoscyamin
Benzeneacetic acid, α-methylene-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, endo-
Tropine,atropate (ester)
Apoatropine
Atropamine