Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-(1-pyrrolidinyl)ethyl ester

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Names

[ CAS No. ]:
4398-62-3

[ Name ]:
Benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 2-(1-pyrrolidinyl)ethyl ester

[Synonym ]:
HMS3085E14
Benzilsaeure-<2-pyrrolidino-aethylester>
BRL 539

Chemical & Physical Properties

[ Density]:
1.178g/cm3

[ Boiling Point ]:
429.5ºC at 760 mmHg

[ Molecular Formula ]:
C20H23NO3

[ Molecular Weight ]:
325.40200

[ Flash Point ]:
213.6ºC

[ Exact Mass ]:
325.16800

[ PSA ]:
49.77000

[ LogP ]:
2.49940

[ Index of Refraction ]:
1.584

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DD4620000
CHEMICAL NAME :
Benzilic acid, 2-(1-pyrrolidinyl)ethyl ester
CAS REGISTRY NUMBER :
4398-62-3
BEILSTEIN REFERENCE NO. :
0037393
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C20-H23-N-O3
MOLECULAR WEIGHT :
325.44

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
27 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BJPCAL British Journal of Pharmacology and Chemotherapy. (London, UK) V.1-33, 1946-68. For publisher information, see BJPCBM. Volume(issue)/page/year: 12,447,1957

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-(2-Chloroethyl)pyrrolidine
  • Benzilic acid
  • 2-chloroethylpyrrolidine hydrochloride

DownStream

Related Compounds

  • 5-[(Cyclopentylamino)sulfonyl]indolinyl 4-methoxyphenyl ketone
  • Benzene, 1,1a(2)-[nitro(phenylsulfinyl)ethenylidene]bis-
  • 3-[4-[(Methanesulfonyl)amino]phenyl]propionic acid
  • Methyl[4-(pyrrolidin-1-yl)butyl]amine
  • Methyl 2-[[(2,3-dihydro-2-benzofuranyl)carbonyl]amino]-5-thiazolecarboxylate
  • 4-[2-[(2-Bromophenyl)methoxy]ethyl]morpholine
  • Methyl 2-[[4-(2-oxo-1-piperidinyl)benzoyl]amino]-5-thiazolecarboxylate
  • 4,4-Bis(4-fluorophenyl)butan-1-amine
  • 3-(3-Bromopropyl)furan
  • 2-(2,5-Dimethylphenoxy)-N-[2-(4-morpholinyl)-1-phenylethyl]acetamide
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