1-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]propan-2-ol,oxalic acid

Names

[ CAS No. ]:
2323-36-6

[ Name ]:
1-[4-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]piperazin-1-yl]propan-2-ol,oxalic acid

Chemical & Physical Properties

[ Density]:
0.954g/cm3

[ Boiling Point ]:
272.5ºC at 760mmHg

[ Melting Point ]:
141-142ºC

[ Molecular Formula ]:
C13H17N

[ Molecular Weight ]:
187.28100

[ Flash Point ]:
108.4ºC

[ Exact Mass ]:
187.13600

[ PSA ]:
3.24000

[ LogP ]:
2.18260

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SH6049000
CHEMICAL NAME :
Phenethylamine, N,alpha-dimethyl-N-2-propynyl-
CAS REGISTRY NUMBER :
2323-36-6
LAST UPDATED :
199509
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C13-H17-N
MOLECULAR WEIGHT :
187.31

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 31,1253,1988 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Subcutaneous
DOSE :
66 mg/kg
SEX/DURATION :
female 2-23 day(s) after conception
TOXIC EFFECTS :
Reproductive - Maternal Effects - parturition Reproductive - Specific Developmental Abnormalities - Central Nervous System Reproductive - Effects on Newborn - behavioral
REFERENCE :
NEROEW Neuropsychopharmacology. (Elsevier Science, 655 Avenue of the Americas, New York, NY 10010) V.1- 1987- Volume(issue)/page/year: 11,125,1994

Safety Information

[ RIDADR ]:
UN 1851

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1(b)

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • (-)-2-[methylamino]-1-phenylpropane
  • 3-Bromopropyne
  • (2R)-1-phenyl-N-prop-2-ynylpropan-2-amine
  • methyl iodide
  • 3-Phenylpropanal
  • (S)-1-PHENYLPROPAN-2-OL
  • (R)-(2,3-epoxypropyl)-benzene
  • 1,2-Propanediol,3-phenyl-
  • (R)-3-phenyl-2-(N-phenyl-aminooxy)-propan-1-ol

DownStream

Related Compounds

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 4-(8-Amino-2-furan-2-yl-[1,2,4]triazolo[1,5-a]pyrazin-6-yl)-benzoic acid
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • 4-Bromo-N-methyl-N-[2-oxo-2-[(2,2,2-trifluoroethyl)amino]ethyl]benzamide
  • tert-Butyl-DL-alanine