Benzeneacetic acid, α-hydroxy-α-1-propyn-1-yl-, (1-methyl-4-piperidinyl)methyl ester, hydrochloride
Names
[ CAS No. ]:
92956-06-4
[ Name ]:
Benzeneacetic acid, α-hydroxy-α-1-propyn-1-yl-, (1-methyl-4-piperidinyl)methyl ester, hydrochloride
[Synonym ]:
(1-methylpiperidin-1-ium-4-yl)methyl 2-hydroxy-2-phenylpent-3-ynoatechloride
Benzeneacetic acid, α-hydroxy-α-1-propynyl-, (1-methyl-4-piperidinyl)methyl ester, hydrochloride
Chemical & Physical Properties
[ Molecular Formula ]:
C18H24ClNO3
[ Molecular Weight ]:
337.84100
[ Exact Mass ]:
337.14400
[ PSA ]:
49.77000
[ LogP ]:
2.52240
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- OO7939000
- CHEMICAL NAME :
- Mandelic acid, alpha-(1-propynyl)-, (1-methyl-4-piperidyl)methyl ester, hydrochloride
- CAS REGISTRY NUMBER :
- 92956-06-4
- LAST UPDATED :
- 199012
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C18-H23-N-O3.Cl-H
- MOLECULAR WEIGHT :
- 337.88
- WISWESSER LINE NOTATION :
- T6NTJ A1 D1OVXQR&1UU2 &GH
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 :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#11475