Boc-(S)-alpha-(4-fluorobenzyl)-proline supplier

Name
BOC-(S)-ALPHA-(4-FLUOROBENZYL)-PROLINE
EINECS
CAS No. 706806-65-7
Density 1.242 g/cm³
Solubility
Melting Point 190-192℃
Formula C₁₇H₂₂FNO₄
Boiling Point 447.4 °C at 760 mmHg
Molecular Weight 323.364
Flash Point 224.4 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms (S)-1-BOC-2-(4-FLUOROBENZYL)-2-PYRROLIDINECARBOXYLIC ACID;BOC-ALPHA-(4-FLUOROBENZYL)-D-PROLINE;BOC-(S)-ALPHA-(4-FLUOROBENZYL)-PROLINE;BOC-(S)-ALPHA-(4-FLUOROBENZYL)-PRO-OH;Boc-(S)-a-(4-fluoro-benzyl)-proline;boc-(s)-α-(4-fluorobenzyl)-pro-oh;Boc-α-(4-fluorobenzyl)-D-proline, (S)-1-Boc-2-(4-fluorobenzyl)-2-pyrrolidinecarboxylic acid;N-Boc-(S)-1-(4-fluorobenzyl)-DL-proline, 95%
PSA 66.84000
LogP 3.16040

Boc-(S)-alpha-(4-fluorobenzyl)-proline Specification

This chemical is called Boc-(S)-alpha-(4-fluorobenzyl)-proline, and it's also named as 1-(tert-Butoxycarbonyl)-2-(4-fluorobenzyl)-D-proline. With the molecular formula of C₁₇H₂₂FNO₄, its molecular weight is 323.36. The CAS registry number of this chemical is 706806-65-7. Additionally, its product category is Alpha-Substituted Proline Analogs.

Other characteristics of the Boc-(S)-alpha-(4-fluorobenzyl)-proline can be summarised as followings: (1)ACD/LogP: 2.85; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 55.84 Å²; (7)Index of Refraction: 1.543; (8)Molar Refractivity: 82 cm³; (9)Molar Volume: 260.1 cm³; (10)Polarizability: 32.5×10^-24cm³; (11)Surface Tension: 49.1 dyne/cm; (12)Density: 1.242 g/cm³; (13)Flash Point: 224.4 °C; (14)Enthalpy of Vaporization: 74.37 kJ/mol; (15)Boiling Point: 447.4 °C at 760 mmHg; (16)Vapour Pressure: 8.69E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Fc1ccc(cc1)C[C@@]2(C(=O)O)N(C(=O)OC(C)(C)C)CCC2
2.InChI: InChI=1/C17H22FNO4/c1-16(2,3)23-15(22)19-10-4-9-17(19,14(20)21)11-12-5-7-13(18)8-6-12/h5-8H,4,9-11H2,1-3H3,(H,20,21)/t17-/m0/s1
3.InChIKey: AWTXCFLBYUGCEW-KRWDZBQOBR

Product Name

BOC-(S)-ALPHA-(4-FLUOROBENZYL)-PROLINE

Boc-(S)-alpha-(4-fluorobenzyl)-proline Specification

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