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| CAS No.: | 66068-76-6 |
|---|---|
| Name: | (S)-(+)-(1-AMINOETHYL)PHOSPHONIC ACID |
| Article Data: | 5 |
| Molecular Structure: | |
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| Formula: | C2H8NO3P |
| Molecular Weight: | 125.064 |
| Synonyms: | Phosphonicacid, (1-aminoethyl)-, (S)-;Phosphonic acid, [(1S)-1-aminoethyl]- (9CI);(S)-(+)-(1-Aminoethyl)phosphonic acid;(S)-(1-Aminoethyl)phosphonic acid; |
| Density: | 1.475 g/cm3 |
| Melting Point: | 290 °C (dec.)(lit.) |
| Boiling Point: | 319.2 °C at 760 mmHg |
| Flash Point: | 146.9 °C |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| PSA: | 93.36000 |
| LogP: | 0.16910 |
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Specification
The Phosphonic acid,P-[(1S)-1-aminoethyl]-, with the CAS registry number 66068-76-6, is also known as D-(+)-1-Aminoethylphosphonic acid. This chemical's molecular formula is C2H8NO3P and molecular weight is 125.06. Its IUPAC name is called [(1S)-1-aminoethyl]phosphonic acid.
Physical properties of Phosphonic acid,P-[(1S)-1-aminoethyl]-: (1)ACD/LogP: -2.41; (2)ACD/LogD (pH 5.5): -5; (3)ACD/LogD (pH 7.4): -5.76; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.495; (12)Molar Refractivity: 24.75 cm3; (13)Molar Volume: 84.7 cm3; (14)Surface Tension: 68.3 dyne/cm; (15)Density: 1.475 g/cm3; (16)Flash Point: 146.9 °C; (17)Enthalpy of Vaporization: 61.66 kJ/mol; (18)Boiling Point: 319.2 °C at 760 mmHg; (19)Vapour Pressure: 7.2E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(N)P(=O)(O)O
(2)Isomeric SMILES: C[C@@H](N)P(=O)(O)O
(3)InChI: InChI=1S/C2H8NO3P/c1-2(3)7(4,5)6/h2H,3H2,1H3,(H2,4,5,6)/t2-/m0/s1
(4)InChIKey: UIQSKEDQPSEGAU-REOHCLBHSA-N