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Fmoc-D-Pipecolic acid

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Name

Fmoc-D-Pipecolic acid

EINECS N/A
CAS No. 101555-63-9 Density 1.293 g/cm3
PSA 66.84000 LogP 3.81250
Solubility N/A Melting Point 149-153 °C
Formula C21H21NO4 Boiling Point 561.6 °C at 760 mmHg
Molecular Weight 351.402 Flash Point 293.5 °C
Transport Information N/A Appearance white to light yellow crystal powder
Safety 26-36-37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 101555-63-9 (FMOC-D-PIPECOLIC ACID) Hazard Symbols IrritantXi
Synonyms

1,2-Piperidinedicarboxylicacid, 1-(9H-fluoren-9-ylmethyl) ester, (R)-;D-1-Fmoc-Pipecolinic acid;(R)-N-Fmoc-piperidine-2-carboxylic acid;(R)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)piperidine-2-carboxylic acid;

Article Data 15

Fmoc-D-Pipecolic acid Specification

The systematic name of Fmoc-D-Pipecolic acid is (2R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid. With the CAS registry number 101555-63-9, it is also named as (R)-N-Fmoc-piperidine-2-carboxylic acid. The product's categories are Unusual Amino Acids; Chiral; Pyridine; Amino Acids. In addition, its molecular formula is C21H21NO4 and its molecular weight is 351.40. This chemical is white to light yellow crystal powder, which should be stored at 2-8 °C.

The other characteristics of Fmoc-D-Pipecolic acid can be summarized as: (1)ACD/LogP: 3.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.03; (4)ACD/LogD (pH 7.4): 0.31; (5)ACD/BCF (pH 5.5): 8.79; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 60.29; (8)ACD/KOC (pH 7.4): 1.15; (9)H bond acceptors: 5; (10)H bond donors: 1; (11)Freely Rotating Bonds: 4; (12)Index of Refraction: 1.62; (13)Molar Refractivity: 95.49 cm3; (14)Molar Volume: 271.7 cm3; (15)Surface Tension: 56.6 dyne/cm; (16)Density: 1.293 g/cm3; (17)Flash Point: 293.5 °C; (18)Melting Point: 149-153 °C; (19)Enthalpy of Vaporization: 88.85 kJ/mol; (20)Boiling Point: 561.6 °C at 760 mmHg; (21)Vapour Pressure: 1.89E-13 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing, gloves and eye / face protection when use it. Moreover, in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=C(OCC3c1ccccc1c2ccccc23)N4[C@@H](C(=O)O)CCCC4
(2)InChI:InChI=1/C21H21NO4/c23-20(24)19-11-5-6-12-22(19)21(25)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,23,24)/t19-/m1/s1
(3)InChIKey:CKLAZLINARHOTG-LJQANCHMBR
(4)Std. InChI:InChI=1S/C21H21NO4/c23-20(24)19-11-5-6-12-22(19)21(25)26-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,23,24)/t19-/m1/s1
(5)Std. InChIKey:CKLAZLINARHOTG-LJQANCHMSA-N

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