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| Name |
Clopipazan mesylate |
EINECS | N/A |
| CAS No. | 60086-22-8 | Density | g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C19H18ClNO•CH4O3S | Boiling Point | 444.3°Cat760mmHg |
| Molecular Weight | 407.94 | Flash Point | 222.5°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by ingestion and intraperitoneal routes. Unspecified human systemic effects by ingestion. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
Clopipazan mesylate Chemical Properties
IUPAC Name: 4-(2-chloroxanthen-9-ylidene)-1-methylpiperidine ; methanesulfonic acid
Molecular Formula: C20H22ClNO4S
H-Bond Donor: 1
H-Bond Acceptor: 5
Rotatable Bond Count: 0
Exact Mass: 407.095807
MonoIsotopic Mass: 407.095807
SMILES: O=S(=O)(O)C.Clc2cc1C(\c3c(Oc1cc2)cccc3)=C4/CCN(C)CC4
InChI: InChI=1/C19H18ClNO.CH4O3S/c1-21-10-8-13(9-11-21)19-15-4-2-3-5-17(15)22-18-7-6-14(20)12-16(18)19;1-5(2,3)4/h2-7,12H,8-11H2,1H3;1H3,(H,2,3,4)
InChIKey: CPNAKTVMAXLKKO-UHFFFAOYAH
Flash Point: 222.5 °C
Boiling Point: 444.3 °C at 760 mmHg
Enthalpy of Vaporization: 70.21 kJ/mol
Vapour Pressure: 4.33E-08 mmHg at 25°C
Structure of Clopipazan mesylate (CAS NO.60086-22-8):
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Clopipazan mesylate Toxicity Data With Reference
| 1. | orl-hmn TDLo:9140 µg/kg/28D | DRFUD4 Drugs of the Future. 6 (1981),15. | ||
| 2. | orl-rat LD50:319 mg/kg | DRFUD4 Drugs of the Future. 6 (1981),15. | ||
| 3. | ipr-rat LD50:80 mg/kg | DRFUD4 Drugs of the Future. 6 (1981),15. | ||
| 4. | ipr-mus LD50:57 mg/kg | DRFUD4 Drugs of the Future. 6 (1981),15. |
Clopipazan mesylate Safety Profile
Poison by ingestion and intraperitoneal routes. Unspecified human systemic effects by ingestion. When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.
Clopipazan mesylate Specification
Clopipazan mesylate , its cas register number is 60086-22-8. It also can be called 4-(2-chloroxanthen-9-ylidene)-1-methylpiperidine and methanesulfonic acid .When heated to decomposition it emits toxic fumes of Cl−, NOx, and SOx.
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