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Cas Database |
| Name |
Neticonazole hydrochloride |
EINECS | N/A |
| CAS No. | 130773-02-3 | Density | 1.06g/cm3 |
| PSA | 52.35000 | LogP | 5.46380 |
| Solubility | N/A | Melting Point |
145-147° |
| Formula | C17H22 N2 O S . Cl H | Boiling Point | 464°Cat760mmHg |
| Molecular Weight | 338.901 | Flash Point | 234.4°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Moderately toxic by ingestion and subcutaneous routes. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of NOx, SOx, HCl, and Cl−. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | Moderately toxic by ingestion. |
| Synonyms |
1H-Imidazole,1-[(1E)-2-(methylthio)-1-[2-(pentyloxy)phenyl]ethenyl]-, monohydrochloride(9CI); 1H-Imidazole, 1-[2-(methylthio)-1-[2-(pentyloxy)phenyl]ethenyl]-,monohydrochloride, (E)-; Neticonazole hydrochloride; SS 717 |
Article Data | 1 |
Neticonazole hydrochloride Chemical Properties
Molecular Formula of Neticonazole hydrochloride (CAS NO.130773-02-3): C17H23ClN2OS
Molecular Weight: 338.89532 g/mol
Structure of Neticonazole hydrochloride (CAS NO.130773-02-3):
.png)
IUPAC Name: 1-[(E)-2-Methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole hydrochloride
Canonical SMILES: CCCCCOC1=CC=CC=C1C(=CSC)N2C=CN=C2.Cl
Isomeric SMILES: CCCCCOC1=CC=CC=C1/C(=C\SC)/N2C=CN=C2.Cl
InChI: InChI=1S/C17H22N2OS.ClH/c1-3-4-7-12-20-17-9-6-5-8-15(17)16(13-21-2)19-11-10-18-14-19;/h5-6,8-11,13-14H,3-4,7,12H2,1-2H3;1H/b16-13+;
InChIKey: HAHMABKERDVYCH-ZUQRMPMESA-N
Neticonazole hydrochloride Toxicity Data With Reference
| 1. | orl-rat LD50:1650 mg/kg | NIIRDN Drugs in Japan. Ethical Drugs, 6th Edition 1982 Edited by Japan Pharmaceutical Information Center.(Yakugyo Jiho Co., Ltd.,Tokyo, Japan.: )1995,945. | ||
| 2. | scu-rat LD50:4740 mg/kg | YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. 35 (1993),2933. | ||
| 3. | orl-mus LD50:820 mg/kg | NIIRDN Drugs in Japan. Ethical Drugs, 6th Edition 1982 Edited by Japan Pharmaceutical Information Center.(Yakugyo Jiho Co., Ltd.,Tokyo, Japan.: )1995,945. | ||
| 4. | scu-mus LD50:890 mg/kg | YAKUD5 Gekkan Yakuji. Pharmaceuticals Monthly. 35 (1993),2933. |
Neticonazole hydrochloride Safety Profile
Moderately toxic by ingestion and subcutaneous routes. Experimental reproductive effects. When heated to decomposition Neticonazole hydrochloride (CAS NO.130773-02-3) emits toxic vapors of NOx, SOx, HCl, and Cl−.
Neticonazole hydrochloride Specification
Neticonazole hydrochloride , its cas register number is 130773-02-3. It also can be called (E)-(1-(2-Pentyloxyphenyl)-1-imidazolyl-2-methylthio)ethylene hydrochloride ; Neticonazole HCl ; and SS717 .
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