Benactyzine

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Names

[ CAS No. ]:
302-40-9

[ Name ]:
Benactyzine

[Synonym ]:
Benzilsaeure-(2-diaethylamino-aethylester)
Benzilic acid,2-(diethylamino)ethyl ester
Benzactyzine
Benactyzinum [INN-Latin]
Benactizina [Italian]
Diphenyl-glykolsaeure-<2-diaethylamino-aethylester>
Benactyzin
Benacticina [INN-Spanish]
2-diethylaminoethyl benzilate
Diethylaminoethyl benzilate
BENACTYZINE
Benactizina [DCIT]

Chemical & Physical Properties

[ Density]:
1.115 g/cm3

[ Boiling Point ]:
409.3ºC at 760 mmHg

[ Melting Point ]:
51ºC

[ Molecular Formula ]:
C20H25NO3

[ Molecular Weight ]:
327.41700

[ Flash Point ]:
201.4ºC

[ Exact Mass ]:
327.18300

[ PSA ]:
49.77000

[ LogP ]:
2.80750

[ Index of Refraction ]:
1.557

[ Storage condition ]:
2-8°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DD2480000
CHEMICAL NAME :
Benzilic acid, 2-(diethylamino)ethyl ester
CAS REGISTRY NUMBER :
302-40-9
BEILSTEIN REFERENCE NO. :
2156821
LAST UPDATED :
199612
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C20-H25-N-O3
MOLECULAR WEIGHT :
327.46
WISWESSER LINE NOTATION :
QXR&R&VO2N2&2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Human
DOSE/DURATION :
100 ug/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation)
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
135 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
159 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold

MUTATION DATA

TEST SYSTEM :
Rodent - hamster
DOSE/DURATION :
10 mg/kg
REFERENCE :
ACNSAX Activitas Nervosa Superior. (Avicenum, Malostranske nam. 28, Prague 1, Czechoslovakia) V.1- 1959- Volume(issue)/page/year: 17,253,1975

Safety Information

[ Hazard Codes ]:
T

[ Risk Phrases ]:
23/24/25

[ Safety Phrases ]:
36/37/39-45

[ HS Code ]:
2922509090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 2-Diethylaminoethylchloride Hydrochloride
  • Potassium Benzilate
  • Benzilic acid
  • 2-Chloro-N,N-diethylethanamine
  • 2-(Diethylamino)ethanol
  • 2-chloro-2,2-diphenylacetyl chloride
  • Benzeneacetic acid, a-hydroxy-a-phenyl-, ethyl ester

DownStream

  • Methylbenactyzium Bromide
  • 2-(diethylamino)ethyl 2-chloro-2,2-diphenylacetate
  • triethyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]azanium,iodide

Customs

[ HS Code ]: 2922509090

[ Summary ]:
2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • Benactyzine hydrochloride
  • Benactyzine hydrochloride
  • 4-(2-Methoxy-6-methylphenyl)butan-2-ol
  • {2-[3-(trifluoromethyl)-1H-pyrazol-4-yl]cyclopropyl}methanamine
  • 3-(Difluoromethoxy)-4-(piperidin-4-yl)benzoic acid
  • 6,7-Difluoro-4-(propan-2-yloxy)quinoline
  • (3R)-1-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)acetyl]piperidine-3-carboxylic acid
  • 4-chloro-1-methyl-5-{4H,5H,6H,7H-thieno[3,2-c]pyridin-4-yl}-1H-pyrazole
  • 4-(2-methylfuran-3-yl)-4H,5H,6H,7H-thieno[3,2-c]pyridine
  • 5-Bromo-6-cyclobutyl-3-methyl-3,4-dihydropyrimidin-4-one
  • 7-Chloropyrazolo[1,5-a]pyrimidine-5-carbonyl chloride
  • 7-Ethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-5-ol
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