-
Name
5,5-diphenyl-3-(3-piperidin-1-ylpropyl)-2-thioxoimidazolidin-4-one hydrochloride
- EINECS
- CAS No. 101564-69-6
- Density g/cm3
- Solubility
- Melting Point
- Formula C23H27 N3 O S . Cl H
- Boiling Point 527.3°Cat760mmHg
- Molecular Weight 430.05
- Flash Point 272.7°C
- Transport Information
- Appearance
- Safety Poison by subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of SOx, NOx, and HCl.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 4-Imidazolidinone,5,5-diphenyl-3-[3-(1-piperidinyl)propyl]-2-thioxo-, monohydrochloride (9CI);Hydantoin, 5,5-diphenyl-3-(3-piperidinopropyl)-2-thio-, hydrochloride (6CI)
- PSA
- LogP
5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride Chemical Properties
IUPAC Name: 5,5-diphenyl-3-(3-piperidin-1-ylpropyl)-2-sulfanylideneimidazolidin-4-one hydrochloride
Empirical Formula: C23H28ClN3OS
Molecular Weight: 430.0059g/mol
Structure of 5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride (CAS NO.101564-69-6):
Flash Point: 272.7 °C
Enthalpy of Vaporization: 80.19 kJ/mol
Boiling Point: 527.3 °C at 760 mmHg
Vapour Pressure: 3.3E-11 mmHg at 25°C
Classification Code: Drug / Therapeutic Agent
Canonical SMILES: C1CCN(CC1)CCCN2C(=O)C(NC2=S)(C3=CC=CC=C3)C4=CC=CC=C4.Cl
InChI: InChI=1S/C23H27N3OS.ClH/c27-21-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)24-22(28)26(21)18-10-17-25-15-8-3-9-16-25;/h1-2,4-7,11-14H,3,8-10,15-18H2,(H,24,28);1H
InChIKey: JYVZUMXXEWQMGX-UHFFFAOYSA-N
5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride Toxicity Data With Reference
| 1. | ipr-mus LD50:35 mg/kg | FRPSAX Farmaco, Edizione Scientifica. 15 (1960),809. | ||
| 2. | scu-mus LD50:30 mg/kg | FRPSAX Farmaco, Edizione Scientifica. 15 (1960),809. | ||
| 3. | ivn-rbt LD50:3350 µg/kg | FRPSAX Farmaco, Edizione Scientifica. 15 (1960),809. |
5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride Safety Profile
Poison by subcutaneous, intravenous, and intraperitoneal routes. When heated to decomposition it emits toxic fumes of SOx, NOx, and HCl.
5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride Specification
5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride , its cas register number is 101564-69-6. It also can be called 3-gamma-(1-Piperidino)propil-5,5-difeniltioidantoina cloridrato . When 5,5-Diphenyl-3-(3-piperidinopropyl)-2-thio-hydantoin hydrochloride (CAS NO.101564-69-6) is heated to decomposition, it emits toxic fumes of SOx, NOx, and HCl.
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