Basic information
- Name:
Synephrine hydrochloride
- CAS No.:
5985-28-4
- Molecular Structure:
- Formula:
- C9H13NO2.HCl
- Molecular Weight:
- 203.67
- Synonyms:
- Benzenemethanol,4-hydroxy-a-[(methylamino)methyl]-, hydrochloride(9CI);Benzyl alcohol, p-hydroxy-a-[(methylamino)methyl]-,hydrochloride (8CI);Oxedrine hydrochloride;
- EINECS:
- 227-804-6
- Boiling Point:
- 341.1 °C at 760 mmHg
- Flash Point:
- 163.4 °C
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Chemistry
Product Name:Synephrine hydrochloride (CAS NO.5985-28-4)
Molecular Formula: C9H14ClNO2
Molecular Weight: 203.67g/mol
Mol File: 5985-28-4.mol
EINECS: 227-804-6
Boiling point: 341.1 °C at 760 mmHg
Flash Point: 163.4 °C
Enthalpy of Vaporization: 61.71 kJ/mol
Vapour Pressure: 3.18E-05 mmHg at 25°C
H-Bond Donor: 3
H-Bond Acceptor: 3
Structure Descriptors of ynephrine hydrochloride (CAS NO.5985-28-4):
IUPAC Name: [2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methylazanium chloride
Canonical SMILES: C[NH2+]CC(C1=CC=C(C=C1)O)O.[Cl-]
InChI: InChI=1S/C9H13NO2.ClH/c1-10-6-9(12)7-2-4-8(11)5-3-7;/h2-5,9-12H,6H2,1H3;1H
InChIKey: COTCEGYSNTWJQV-UHFFFAOYSA-N
Classification Code: Drug / Therapeutic Agent
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| guinea pig | LDLo | subcutaneous | 500mg/kg (500mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 124, Pg. 231, 1927. | |
| mouse | LDLo | subcutaneous | 400mg/kg (400mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 124, Pg. 231, 1927. | |
| rat | LDLo | subcutaneous | 320mg/kg (320mg/kg) | Journal of Pharmacology and Experimental Therapeutics. Vol. 71, Pg. 62, 1941. |
Specification
Synephrine hydrochloride , its CAS NO. is 5985-28-4, the synonyms are Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-, hydrochloride ; Synephrine HCl ; l-1-p-Hydroxyphenyl-2-methylamino-1-ethanol hydrochloride ; p-Hydroxy-alpha-(methylaminomethyl)benzyl alcohol hydrochloride ; p-Methylaminoaethanolphenol hydrochlorid ; 4-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol hydrochloride ; Benzyl alcohol, p-hydroxy-alpha-((methylamino)methyl)-, hydrochloride .