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L-2-Nitrophenylalanine

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Name

L-2-Nitrophenylalanine

EINECS N/A
CAS No. 19883-75-1 Density 1.408 g/cm3
PSA 109.14000 LogP 1.77270
Solubility N/A Melting Point 223 °C (dec.)
Formula C9H10N2O4 Boiling Point 385.4 °C at 760 mmHg
Molecular Weight 210.189 Flash Point 186.9 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 19883-75-1 (L-2-NITROPHENYLALANINE) Hazard Symbols IrritantXi
Synonyms

Alanine,3-(o-nitrophenyl)-, L- (8CI);NSC 21949;2-Nitro-L- phenylalanine ,;

Article Data 7

L-2-Nitrophenylalanine Specification

The L-Phenylalanine,2-nitro-, with the CAS registry number 19883-75-1, is also known as L-2-Nitrophe and L-2-Nitrophenylalanine. It belongs to the product categories of Amino Acids; Phenylalanine Analogs and Other Aromatic Alpha Amino Acids. This chemical's molecular formula is C9H10N2O4 and molecular weight is 210.19. What's more, its IUPAC name is (2S)-2-Amino-3-(2-nitrophenyl)propanoic acid and systematic name is called 2-Nitro-L-phenylalanine.

Physical properties about L-Phenylalanine,2-nitro- are: (1) ACD/LogP: 0.84; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): -1.65; (4) ACD/LogD (pH 7.4): -1.72; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1; (8) ACD/KOC (pH 7.4): 1; (9) #H bond acceptors: 6; (10) #H bond donors: 3; (11) #Freely Rotating Bonds: 5; (12) Polar Surface Area: 75.36 Å2; (13) Index of Refraction: 1.614; (14) Molar Refractivity: 52.03 cm3; (15) Molar Volume: 149.2 cm3; (16) Surface Tension: 67.1 dyne/cm; (17) Density: 1.408 g/cm3; (18) Flash Point: 186.9 °C; (19) Enthalpy of Vaporization: 66.89 kJ/mol; (20) Boiling Point: 385.4 °C at 760 mmHg; (21) Vapour Pressure: 1.25E-06 mmHg at 25 °C; (22) Melting Point: 206-208 °C.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. And in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [O-][N+](=O)c1ccccc1C[C@H](N)C(=O)O
(2) InChI: InChI=1/C9H10N2O4/c10-7(9(12)13)5-6-3-1-2-4-8(6)11(14)15/h1-4,7H,5,10H2,(H,12,13)/t7-/m0/s1
(3) InChIKey: SDZGVFSSLGTJAJ-ZETCQYMHBL

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