Basic Information | Post buying leads | Suppliers |
Name |
Metaraminol bitartrate |
EINECS | 251-502-3 |
CAS No. | 33402-03-8 | Density | N/A |
PSA | 181.54000 | LogP | -0.64950 |
Solubility | N/A | Melting Point |
176-177° |
Formula | C9H13NO2.C4H6O6 | Boiling Point | 357.9 °C at 760 mmHg |
Molecular Weight | 317.29 | Flash Point | 170.3 °C |
Transport Information | UN 2811 6.1/PG 3 | Appearance | Colourless solid |
Safety | 26-28-36/37/39-45 | Risk Codes | 23/24/25 |
Molecular Structure | Hazard Symbols | T | |
Synonyms |
Aramine;Benzyl alcohol, α-(1-aminoethyl)-m-hydroxy-, (-)-, tartrate (1:1) (salt) (8CI);3-[(1R,2S)-2-amino-1-hydroxy-propyl]phenol; (2R,3R)-2,3-dihydroxybutanedioic acid;Benzenemethanol,R-[(1S)-1-aminoethyl]-3- hydroxy-,(RR)-,(2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt);Benzenemethanol, α-[(1S)-1-aminoethyl]-3-hydroxy-, (αR)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1); |
metaraminol hydrogen (+)-tartrate
A
4-<125I>iodometaraminol
B
6-<125I>iodometaraminol
Conditions | Yield |
---|---|
With sodium hydroxide; potassium phosphate buffer; sodium (¹²⁵I)iodide; chloroamine-T for 0.0833333h; Ambient temperature; ph = 6.75; Yield given. Yields of byproduct given; | |
With sodium hydroxide; potassium phosphate buffer; sodium (¹²⁵I)iodide; chloroamine-T for 0.0833333h; Ambient temperature; pH = 6.75; Yield given. Yields of byproduct given; |
metaraminol hydrogen (+)-tartrate
5-(2-Amino-1-hydroxy-propyl)-2-iodo-phenol
Conditions | Yield |
---|---|
With ammonium hydroxide; iodine In ethanol for 18h; |
The Metaraminol bitartrate, with the CAS registry number 33402-03-8, is also known as Benzenemethanol, α-[(1S)-1-aminoethyl]-3-hydroxy-, (αR)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1). Its EINECS number is 251-502-3. This chemical's molecular formula is C9H13NO2.C4H6O6 and molecular weight is 317.29. What's more, its systematic name is 3-[(1R,2S)-2-amino-1-hydroxy-propyl]phenol; (2R,3R)-2,3-dihydroxybutanedioic acid. Its classification codes are: (1)Adrenergic; (2)Diagnostic aid [paramagnetic]; (3)Drug / Therapeutic Agent.
Physical properties of Metaraminol bitartrate are: (1)ACD/LogP: 0.072; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 4; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 21.7 Å2; (7)Flash Point: 170.3 °C; (8)Enthalpy of Vaporization: 63.66 kJ/mol; (9)Boiling Point: 357.9 °C at 760 mmHg; (10)Vapour Pressure: 9.58E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is toxic by inhalation, in contact with skin and if swallowed. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. After contact with skin, you must wash immediately with plenty of ... (to be specified by the manufacturer). In case of accident or if you feel unwell, you should seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(O)C(O)C(=O)O.O[C@H](c1cc(O)ccc1)[C@@H](N)C
(2)Std. InChI: InChI=1S/C9H13NO2.C4H6O6/c1-6(10)9(12)7-3-2-4-8(11)5-7;5-1(3(7)8)2(6)4(9)10/h2-6,9,11-12H,10H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t6-,9-;/m0./s1
(3)Std. InChIKey: VENXSELNXQXCNT-YDYUUSCQSA-N
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 680mg/kg (680mg/kg) | GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) SKIN AND APPENDAGES (SKIN): HAIR: OTHER | Toxicology and Applied Pharmacology. Vol. 15, Pg. 304, 1969. |
mouse | LD50 | intravenous | 39mg/kg (39mg/kg) | Drugs in Japan Vol. 6, Pg. 820, 1982. | |
mouse | LD50 | oral | 99mg/kg (99mg/kg) | Drugs in Japan Vol. 6, Pg. 820, 1982. | |
rat | LD50 | intraperitoneal | 41mg/kg (41mg/kg) | Drugs in Japan Vol. 6, Pg. 820, 1982. | |
rat | LD50 | intravenous | 3427ug/kg (3.427mg/kg) | VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 281, Pg. 89, 1986. |
rat | LD50 | oral | 240mg/kg (240mg/kg) | Drugs in Japan Vol. 6, Pg. 820, 1982. | |
rat | LD50 | subcutaneous | 117mg/kg (117mg/kg) | Drugs in Japan Vol. 6, Pg. 820, 1982. |