-
Name
3-chloro-5-ethyl-6-hydroxy-2-methoxy-N-{[(2S)-1-methylpyrrolidin-2-yl]methyl}benzamide hydrochloride
- EINECS
- CAS No. 101536-80-5
- Article Data1
- CAS DataBase
- Density g/cm3
- Solubility
- Melting Point
- Formula C16H23 Cl N2 O3 . Cl H
- Boiling Point 417.4°Cat760mmHg
- Molecular Weight 363.32
- Flash Point 206.2°C
- Transport Information
- Appearance
- Safety A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NOx, HCl, and Cl−.
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
S-(-)-3-Chloro-5-ethyl-6-hydroxy-N-((1-methyl-2-pyrrolidinyl)methyl)-o-anisamide HCl Chemical Properties
IUPAC Name: 5-Chloro-3-ethyl-2-hydroxy-6-methoxy-N-[[(2S)-1-methylpyrrolidin-2-yl]methyl]benzamide hydrochloride
Synonyms of S-(-)-3-Chloro-5-ethyl-6-hydroxy-N-((1-methyl-2-pyrrolidinyl)methyl)-o-anisamide HCl (CAS NO.101536-80-5): S-(-)-5-Chloro-3-ethyl-6-methoxy-N-((1-methyl-2-pyrrolidinyl)methyl)salicylamide HCl ; Benzamide, 3-chloro-5-ethyl-6-hydroxy-2-methoxy-N-((1-methyl-2-pyrrolidinyl)methyl)-, monohydrochloride, (S)-
InChI: InChI=1/C16H23ClN2O3.ClH/c1-4-10-8-12(17)15(22-3)13(14(10)20)16(21)18-9-11-6-5-7-19(11)2;/h8,11,20H,4-7,9H2,1-3H3,(H,18,21);1H/t11-;/m0./s1
CAS NO: 101536-80-5
Molecular Formula: C16H24Cl2N2O3
Molecular Weight : 363.2794
Molecular Structure: .png)
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 6
Polar Surface Area: 42.01 Å2
Flash Point: 206.2 °C
Enthalpy of Vaporization: 69.68 kJ/mol
Boiling Point: 417.4 °C at 760 mmHg
Vapour Pressure: 1.46E-07 mmHg at 25°C
S-(-)-3-Chloro-5-ethyl-6-hydroxy-N-((1-methyl-2-pyrrolidinyl)methyl)-o-anisamide HCl Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD50 | intraperitoneal | 216mg/kg (216mg/kg) | European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 20, Pg. 273, 1985. |
S-(-)-3-Chloro-5-ethyl-6-hydroxy-N-((1-methyl-2-pyrrolidinyl)methyl)-o-anisamide HCl Safety Profile
A poison by intraperitoneal route. When S-(-)-3-Chloro-5-ethyl-6-hydroxy-N-((1-methyl-2-pyrrolidinyl)methyl)-o-anisamide HCl (CAS NO.101536-80-5) is heated to decomposition, it emits toxic vapors of NOx, HCl, and Cl−.
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