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| CAS No.: | 69847-45-6 |
|---|---|
| Name: | L-tyrosine, sodium salt (1:2) |
| Molecular Structure: | |
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| Formula: | C9H9NNa2O3 |
| Molecular Weight: | 225.15 |
| Synonyms: | Disodium (2S)-2-amino-3-(4-oxidophenyl)propanoate;disodium 2-amino-3-(4-oxidophenyl)propanoate; |
| EINECS: | 274-152-3 |
| Density: | N/A |
| Melting Point: | N/A |
| Boiling Point: | N/A |
| Flash Point: | N/A |
| Solubility: | N/A |
| Appearance: | Light tan powder |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| Transport Information: | N/A |
| PSA: | 172.76000 |
| LogP: | -0.57560 |
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The L-tyrosine, sodium salt (1:2), with the CAS registry number 69847-45-6 and EINECS registry number 274-152-3, has the IUPAC name of disodium 2-amino-3-(4-oxidophenyl)propanoate. It is a kind of light tan powder, and the molecular formula of the chemical is C9H9NNa2O3.
The characteristics of L-tyrosine, sodium salt (1:2) are as followings: (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 4; (3)Rotatable Bond Count: 2; (4)Exact Mass: 225.037783; (5)MonoIsotopic Mass: 225.037783; (6)Topological Polar Surface Area: 89.2; (7)Heavy Atom Count: 15; (8)Formal Charge: 0; (9)Complexity: 170; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 1; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 3.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cc(ccc1CC(C(=O)[O-])N)[O-].[Na+].[Na+]
(2)InChI: InChI=1/C9H11NO3.2Na/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;;/h1-4,8,11H,5,10H2,(H,12,13);;/q;2*+1/p-2/t8-;;/m0../s1
(3)InChIKey: ASIYFCYUCMQNGK-NXSUYTKKBF
