Fmoc-3-chloro-D-phenylalanine supplier

Name
Fmoc-3-chloro-D-phenylalanine
EINECS
CAS No. 205526-23-4
Density 1.337 g/cm³
Solubility
Melting Point
Formula C₂₄H₂₀ClNO₄
Boiling Point 640.9 °C at 760 mmHg
Molecular Weight 421.88
Flash Point 341.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Fmoc-D-3-chlorophenylalanine;Fmoc-D-3-chlorophe;(2R)-3-(3-Chlorophenyl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid;3-Chloro-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-D-phenylalanine;Fmoc-L-phe(3-Cl)-;OHAC1ODU1Y;CID7020852;AC-16805;
PSA 75.63000
LogP 5.26530

Fmoc-3-chloro-D-phenylalanine Specification

The Fmoc-D-3-chlorophenylalanine with CAS registry number of 205526-23-4 is also known as Fmoc-L-phe(3-Cl)-. The IUPAC name is (2R)-3-(3-Chlorophenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid. It belongs to product categories of Amino Acids; Phenylalanine Analogs and Other Aromatic alpha Amino Acids; Phenylalanine [Phe, F]; Unusual Amino Acids; Fmoc-Amino Acid Series;a-amino. In addition, the formula is C₂₄H₂₀ClNO₄ and the molecular weight is 421.87. Besides, it should be stored at the temperature of 0 °C.

Physical properties about Fmoc-D-3-chlorophenylalanine are: (1)ACD/LogP: 6.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.79; (4)ACD/LogD (pH 7.4): 2.41; (5)ACD/BCF (pH 5.5): 132.59; (6)ACD/BCF (pH 7.4): 5.44; (7)ACD/KOC (pH 5.5): 271.23; (8)ACD/KOC (pH 7.4): 11.12; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 7; (12)Index of Refraction: 1.637; (13)Molar Refractivity: 113.29 cm³; (14)Molar Volume: 315.3 cm³; (15)Surface Tension: 57.9 dyne/cm; (16)Density: 1.337 g/cm³; (17)Flash Point: 341.4 °C; (18)Enthalpy of Vaporization: 99.44 kJ/mol; (19)Boiling Point: 640.9 °C at 760 mmHg; (20)Vapour Pressure: 2.64E-17 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC(=CC=C4)Cl)C(=O)O
2. Isomeric SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CC(=CC=C4)Cl)C(=O)O
3. InChI: InChI=1S/C24H20ClNO4/c25-16-7-5-6-15(12-16)13-22(23(27)28)26-24(29)30-14-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-12,21-22H,13-14H2,(H,26,29)(H,27,28)/t22-/m1/s1
4. InChIKey: UOZAKKJRIKXQPY-JOCHJYFZSA-N

Product Name

Fmoc-3-chloro-D-phenylalanine

Fmoc-3-chloro-D-phenylalanine Specification

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