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Name |
L-2-Cyanophenylalanine |
EINECS | N/A |
CAS No. | 263396-42-5 | Density | 1.28 g/cm3 |
PSA | 87.11000 | LogP | 1.21298 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H10N2O2 | Boiling Point | 375.7 °C at 760 mmHg |
Molecular Weight | 190.20 | Flash Point | 181 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(S)-2-Amino-3-(2-cyanophenyl)propionicacid;(2S)-2-Amino-3-(2-cyanophenyl)propanoic acid; |
The CAS register number of L-2-Cyanophenylalanine is 263396-42-5. It also can be called as (S)-2-Amino-3-(2-cyanophenyl)propionicacid and the IUPAC name about this chemical is (2S)-2-amino-3-(2-cyanophenyl)propanoic acid. The molecular formula about this chemical is C10H10N2O2 and the molecular weight is 190.20. It belongs to the following product categories, such as Amino Acids; PhenylAlAnine AnAlogs And other AromAtic AlphA Amino Acids; Amino Acid DerivAtives; A-Amino and so on.
Physical properties about L-2-Cyanophenylalanine are: (1)ACD/LogP: 0.55; (2)ACD/LogD (pH 5.5): -1.95; (3)ACD/LogD (pH 7.4): -1.99; (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: 3; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 53.33Å2; (12)Index of Refraction: 1.595; (13)Molar Refractivity: 50.45 cm3; (14)Molar Volume: 148.3 cm3; (15)Polarizability: 20x10-24cm3; (16)Surface Tension: 65.1 dyne/cm; (17)Enthalpy of Vaporization: 65.74 kJ/mol; (18)Boiling Point: 375.7 °C at 760 mmHg; (19)Vapour Pressure: 2.6E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)[C@@H](N)Cc1ccccc1C#N
(2)InChI: InChI=1/C10H10N2O2/c11-6-8-4-2-1-3-7(8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1
(3)InChIKey: OCDHPLVCNWBKJN-VIFPVBQEBM
(4)Std. InChI: InChI=1S/C10H10N2O2/c11-6-8-4-2-1-3-7(8)5-9(12)10(13)14/h1-4,9H,5,12H2,(H,13,14)/t9-/m0/s1
(5)Std. InChIKey: OCDHPLVCNWBKJN-VIFPVBQESA-N