Fmoc-Pro-OPfp supplier | CasNO.86060-90-4

Name
FMOC-PRO-OPFP
EINECS
CAS No. 86060-90-4
Article Data2
CAS DataBase
Density 1.455 g/cm³
Solubility
Melting Point 127-129 °C
Formula C₂₆H₁₈F₅NO₄
Boiling Point 573.3 °C at 760 mmHg
Molecular Weight 503.425
Flash Point 300.5 °C
Transport Information
Appearance white powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,2-Pyrrolidinedicarboxylicacid, 1-(9H-fluoren-9-ylmethyl) 2-(pentafluorophenyl) ester, (S)-;N-(Fluorenylmethoxycarbonyl)proline pentafluorophenyl ester;N-9-Fluorenylmethoxycarbonyl-L-proline pentafluorophenyl ester;Fmoc-Pro-OPfp;
PSA 55.84000
LogP 5.63890

Fmoc-Pro-OPfp Specification

The IUPAC name of Fmoc-Pro-OPfp is 1-O-(9H-fluoren-9-ylmethyl) 2-O-(2,3,4,5,6-pentafluorophenyl)(2S)-pyrrolidine-1,2-dicarboxylate. With the CAS registry number 86060-90-4, it is also named as N-9-Fluorenylmethoxycarbonyl-L-proline pentafluorophenyl ester. The product's categories are Amino Acids; Fmoc-Amino Acids and Derivatives; Fmoc-Amino Acid Series. In addition, its molecular formula is C₂₆H₁₈F₅NO₄ and its molecular weight is 503.42. Besides, this chemical is white powder which should be stored in refrigerated, airtight, dry place at 2-8 °C.

The other characteristics of Fmoc-Pro-OPfp can be summarized as: (1)ACD/LogP: 5.73; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 5.73; (4)ACD/LogD (pH 7.4): 5.73; (5)ACD/BCF (pH 5.5): 13399.1; (6)ACD/BCF (pH 7.4): 13399.1; (7)ACD/KOC (pH 5.5): 31314.75; (8)ACD/KOC (pH 7.4): 31314.75; (9)#H bond acceptors: 5; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 55.84 Å²; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 115.56 cm³; (15)Molar Volume: 345.9 cm³; (16)Polarizability: 45.81×10^-24cm³; (17)Surface Tension: 49.8 dyne/cm; (18)Density: 1.455 g/cm³; (19)Flash Point: 300.5 °C; (20)Melting Point: 127-129 °C; (21)Enthalpy of Vaporization: 85.92 kJ/mol; (22)Boiling Point: 573.3 °C at 760 mmHg; (23)Vapour Pressure: 3.77E-13 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(Oc1c(F)c(F)c(F)c(F)c1F)[C@H]5N(C(=O)OCC4c2ccccc2c3ccccc34)CCC5
(2)InChI: InChI=1/C26H18F5NO4/c27-19-20(28)22(30)24(23(31)21(19)29)36-25(33)18-10-5-11-32(18)26(34)35-12-17-15-8-3-1-6-13(15)14-7-2-4-9-16(14)17/h1-4,6-9,17-18H,5,10-12H2/t18-/m0/s1
(3)InChIKey: CQBLOHXKGUNWRV-SFHVURJKBU

Product Name

FMOC-PRO-OPFP

Fmoc-Pro-OPfp Specification

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