4-Iodo-D-phenylalanine supplier

Name
4-IODO-D-PHENYLALANINE
EINECS
CAS No. 62561-75-5
Article Data38
CAS DataBase
Density 1.824 g/cm³
Solubility
Melting Point 251 °C (dec.)(lit.)
Formula C₉H₁₀INO₂
Boiling Point 366.8 °C at 760 mmHg
Molecular Weight 291.088
Flash Point 175.6 °C
Transport Information
Appearance
Safety 24/25
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Iodo-D-phenylalanine;D-p-Iodophenylalanine;p-Iodo-D-phenylalanine;
PSA 63.32000
LogP 1.94590

4-Iodo-D-phenylalanine Specification

The D-Phenylalanine,4-iodo-, with CAS registry number 62561-75-5, belongs to the following product categories: (1)Amino Acids; (2)Phenylalanine analogs and other aromatic alpha amino acids; (3)Miscellaneous; (4)Amino Acid Derivatives; (5)Chiral Compound. It has the systematic name of 4-iodo-D-phenylalanine. This chemical should be stored at the temperature of −20°C. When use this chemical, avoid contact with skin and eyes.

Physical properties of D-Phenylalanine,4-iodo-: (1)ACD/LogP: 2.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.35; (4)ACD/LogD (pH 7.4): -0.36; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.11; (8)ACD/KOC (pH 7.4): 1.09; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.653; (14)Molar Refractivity: 58.4 cm³; (15)Molar Volume: 159.5 cm³; (16)Polarizability: 23.15×10^-24cm³; (17)Surface Tension: 61.9 dyne/cm; (18)Enthalpy of Vaporization: 64.7 kJ/mol; (19)Vapour Pressure: 5.01E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic1ccc(cc1)C[C@H](C(=O)O)N
(2)InChI: InChI=1/C9H10INO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
(3)InChIKey: PZNQZSRPDOEBMS-MRVPVSSYBA
(4)Std. InChI: InChI=1S/C9H10INO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
(5)Std. InChIKey: PZNQZSRPDOEBMS-MRVPVSSYSA-N

Product Name

4-IODO-D-PHENYLALANINE

4-Iodo-D-phenylalanine Specification

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