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Product Name: Synephrine tartrate (CAS NO.67-04-9)
MF: C22H32N2O10
MW: 484.5
EINECS: 200-642-3
Flash Point: 163.4 °C
Enthalpy of Vaporization: 61.71 kJ/mol
Boiling Point: 341.1 °C at 760 mmHg
Vapour Pressure: 3.18E-05 mmHg at 25°C
H-Bond Donor: 10
H-Bond Acceptor: 12
Structure Descriptors of Synephrine tartrate (CAS NO.67-04-9):
IUPAC Name: (2R,3R)-2,3-dihydroxybutanedioic acid;4-[1-hydroxy-2-(methylamino)ethyl]phenol
Canonical SMILES: CNCC(C1=CC=C(C=C1)O)O.CNCC(C1=CC=C(C=C1)O)O.C(C(C(=O)O)O)(C(=O)O)O
Isomeric SMILES: CNCC(C1=CC=C(C=C1)O)O.CNCC(C1=CC=C(C=C1)O)O.[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
InChI: InChI=1S/2C9H13NO2.C4H6O6/c2*1-10-6-9(12)7-2-4-8(11)5-3-7;5-1(3(7)8)2(6)4(9)10/h2*2-5,9-12H,6H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t;;1-,2-/m..1/s1
InChIKey: KZZBAIXGUQOHKI-CEAXSRTFSA-N
Classification Code: Drug / Therapeutic Agent; Reproductive Effect
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 2gm/kg (2000mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 237, Pg. 171, 1959. | |
mouse | LDLo | subcutaneous | 3200mg/kg (3200mg/kg) | BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 166, Pg. 437, 1932. |
rat | LD50 | intraduodenal | 3050mg/kg (3050mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969. | |
rat | LD50 | oral | 4450mg/kg (4450mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969. | |
rat | LD50 | subcutaneous | 2730mg/kg (2730mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 180, Pg. 155, 1969. |
Moderately toxic by intraperitoneal, subcutaneous, and intraduodenal routes. Mildly toxic by ingestion. An experimental teratogen. When heated to decomposition it emits toxic fumes of NOx.
Synephrine tartrate , its CAS NO. is 67-04-9, the synonyms are Benzyl alcohol, p-hydroxy-alpha-((methylamino)methyl)-, tartrate ; Bis(RS)-4-hydroxy-alpha-(methylaminomethyl)benzylalkohol)-(RR)-tartrat ; Cardiodinamin ; DL-p-Synephrine .