-
Name
3-ALPHA-[(4-CHLOROPHENYL)PHENYLMETHOXY] TROPANE HYDROCHLORIDE
- EINECS
- CAS No. 14008-79-8
- Article Data1
- CAS DataBase
- Density g/cm3
- Solubility
- Melting Point
- Formula C21H24 Cl N O . Cl H
- Boiling Point 437.2°Cat760mmHg
- Molecular Weight 378.342
- Flash Point 218.2°C
- Transport Information
- Appearance
- Safety Poison by ingestion, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx and HCl.
- Risk Codes 22
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Molecular Structure
-
Hazard Symbols
- Synonyms 1aH,5aH-Tropane, 3a-[(p-chloro-a-phenylbenzyl)oxy]-, hydrochloride (8CI);8-Azabicyclo[3.2.1]octane, 3-[(4-chlorophenyl)phenylmethoxy]-8-methyl-,hydrochloride, (3-endo)- (9CI); 8-Azabicyclo[3.2.1]octane,3-[(4-chlorophenyl)phenylmethoxy]-8-methyl-, hydrochloride, endo-;Chlortropbenzyl; FC 1; SL 6057; Tropine 4-chlorobenzhydryl ether hydrochloride;WY 2149
- PSA 12.47000
- LogP 5.81110
Chlortropbenzyl Chemical Properties
Empirical Formula: C21H25Cl2NO
Molecular Weight: 378.3353g/mol
IUPAC Name: 3-[(4-chlorophenyl)-phenylmethoxy]-8-methyl-8-azabicyclo[3.2.1]octane hydrochloride
SMILES: Cl.Clc1ccc(cc1)C(OC3CC2N(C)C(CC2)C3)c4ccccc4
InChI: InChI=1/C21H24ClNO.ClH/c1-23-18-11-12-19(23)14-20(13-18)24-21(15-5-3-2-4-6-15)16-7-9-17(22)10-8-16;/h2-10,18-21H,11-14H2,1H3;1H
InChIKey: FXKCQWIUITUJFU-UHFFFAOYAM
Flash Point: 218.2 °C
Boiling Point: 437.2 °C at 760 mmHg
Enthalpy of Vaporization: 69.38 kJ/mol
Vapour Pressure: 7.62E-08 mmHg at 25°C
Structure of Chlortropbenzyl (CAS NO.14008-79-8):
Chlortropbenzyl Toxicity Data With Reference
| 1. | orl-rat LD50:364 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 114 (1955),192. | ||
| 2. | ipr-rat LD50:58 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 114 (1955),192. | ||
| 3. | orl-mus LD50:174 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 114 (1955),192. | ||
| 4. | ipr-mus LD50:32 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 114 (1955),192. | ||
| 5. | ivn-dog LDLo:28 mg/kg | JPETAB Journal of Pharmacology and Experimental Therapeutics. 114 (1955),192. |
Chlortropbenzyl Safety Profile
Poison by ingestion, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx and HCl.
Hazard Codes: 
Xn
Risk Statements: 22
R22:Harmful if swallowed.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
RTECS YM3055500
Chlortropbenzyl Specification
Chlortropbenzyl , its cas register number is 14008-79-8. It also can be called 3-[(4-chlorophenyl)-phenylmethoxy]-8-methyl-8-azabicyclo[3.2.1]octane hydrochloride . When heated to decomposition it emits toxic fumes of NOx and HCl. It's harmful if swallowed. In case of contact Chlortropbenzyl (CAS NO.14008-79-8) with eyes, rinse immediately with plenty of water and seek medical advice.
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