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| Name |
Oxochlorpromazine |
EINECS | N/A |
| CAS No. | 4337-86-4 | Density | 1.299g/cm3 |
| PSA | N/A | LogP | N/A |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C17H19ClN2O2S | Boiling Point | 519°Cat760mmHg |
| Molecular Weight | 350.89 | Flash Point | 267.7°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx, SOx, and Cl−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | A poison. |
| Synonyms |
N/A |
Oxochlorpromazine Chemical Properties
Product Name: Oxochlorpromazine (CAS NO.4337-86-4)
Molecular Formula: C17H19ClN2O2S
Molecular Weight: 350.89g/mol
Mol File: 4337-86-4.mol
Boiling point: 519 °C at 760 mmHg
Flash Point: 267.7 °C
Density: 1.299 g/cm3
Surface Tension: 48.9 dyne/cm
Enthalpy of Vaporization: 79.17 kJ/mol
Vapour Pressure: 7.09E-11 mmHg at 25°C
XLogP3-AA: 3.9
H-Bond Donor: 0
H-Bond Acceptor: 4
Structure Descriptors of Oxochlorpromazine (CAS NO.4337-86-4):
IUPAC Name: 3-(2-chloro-5,5-dioxophenothiazin-10-yl)-N,N-dimethylpropan-1-amine
Canonical SMILES: CN(C)CCCN1C2=CC=CC=C2S(=O)(=O)C3=C1C=C(C=C3)Cl
InChI: InChI=1S/C17H19ClN2O2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)23(21,22)17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3
InChIKey: QBZBVQGQXSKQPX-UHFFFAOYSA-N
Oxochlorpromazine Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intravenous | 30mg/kg (30mg/kg) | Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 53, Pg. 71S, 1957. |
Oxochlorpromazine Safety Profile
A poison by intravenous route. When heated to decomposition it emits toxic vapors of NOx, SOx, and Cl−.
Oxochlorpromazine Specification
Oxochlorpromazine , its CAS NO. is 4337-86-4, the synonyms are 2-Chloro-10-(3-(dimethylamino)propyl)phenothiazine 5,5-dioxide ; 4-27-00-01312 (Beilstein Handbook Reference) ; BRN 0302284 ; Chlorpromazine sulfone ; 10H-Phenothiazine-10-propanamine, 2-chloro-N,N-dimethyl-, 5,5-dioxide (9CI) ; Phenothiazine, 2-chloro-10-(3-(dimethylamino)propyl)-, 5,5-dioxide .
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