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167393-62-6

Basic Information
CAS No.: 167393-62-6
Name: L-Lysine,N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N6-[(4-methylphenyl)diphenylmethyl]-
Molecular Structure:
Molecular Structure of 167393-62-6 (L-Lysine,N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N6-[(4-methylphenyl)diphenylmethyl]-)
Formula: C41H40N2O4
Molecular Weight: 624.77
Synonyms: Fmoc-Lys(Mtt)-OH;Fmoc-N'-methyltrityl-L-lysine;N-(9-Fluorenylmethyloxycarbonyl)-N'-methyltrityl-L-lysine;
EINECS: N/A
Density: 1.198 g/cm3
Melting Point: 140 °C(dec.)
Boiling Point: 798.78 °C at 760 mmHg
Flash Point: 436.887 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 87.66000
LogP: 8.82050
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  • Fmoc-N'-methyltrityl-L-lysine CAS NO.: 167393-62-6

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    167393-62-6

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    167393-62-6

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    167393-62-6

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Specification

The systematic name of Fmoc-Lys(Mtt)-OH is N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N6-[(4-methylphenyl)(diphenyl)methyl]-L-lysine. With the CAS registry number 167393-62-6, it is also named as N-(9-Fluorenylmethyloxycarbonyl)-N'-methyltrityl-L-lysine. The product's categories are Amino Acids; Fmoc-Amino Acids and Derivatives; Fmoc-Amino Acid Series. Besides, it should be stored at -20 °C. In addition, its molecular formula is C41H40N2O4 and molecular weight is 624.77.

The other characteristics of Fmoc-Lys(Mtt)-OH can be summarized as: (1)ACD/LogP: 8.47; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 7; (4)ACD/LogD (pH 7.4): 7; (5)ACD/BCF (pH 5.5): 49946; (6)ACD/BCF (pH 7.4): 40842; (7)ACD/KOC (pH 5.5): 15643; (8)ACD/KOC (pH 7.4): 12792; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 87.66 Å2; (13)Index of Refraction: 1.622; (14)Molar Refractivity: 183.721 cm3; (15)Molar Volume: 521.584 cm3; (16)Polarizability: 72.833×10-24cm3; (17)Surface Tension: 51.809 dyne/cm; (18)Density: 1.198 g/cm3; (19)Flash Point: 436.887 °C; (20)Enthalpy of Vaporization: 121.809 kJ/mol; (21)Boiling Point: 798.78 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(O)[C@@H](NC(=O)OCC3c1ccccc1c2c3cccc2)CCCCNC(c4ccccc4)(c5ccccc5)c6ccc(cc6)C
(2)InChI: InChI=1/C41H40N2O4/c1-29-23-25-32(26-24-29)41(30-14-4-2-5-15-30,31-16-6-3-7-17-31)42-27-13-12-22-38(39(44)45)43-40(46)47-28-37-35-20-10-8-18-33(35)34-19-9-11-21-36(34)37/h2-11,14-21,23-26,37-38,42H,12-13,22,27-28H2,1H3,(H,43,46)(H,44,45)/t38-/m0/s1
(3)InChIKey: YPTNAIDIXCOZAJ-LHEWISCIBL
(4)Std. InChI: InChI=1S/C41H40N2O4/c1-29-23-25-32(26-24-29)41(30-14-4-2-5-15-30,31-16-6-3-7-17-31)42-27-13-12-22-38(39(44)45)43-40(46)47-28-37-35-20-10-8-18-33(35)34-19-9-11-21-36(34)37/h2-11,14-21,23-26,37-38,42H,12-13,22,27-28H2,1H3,(H,43,46)(H,44,45)/t38-/m0/s1
(5)Std. InChIKey: YPTNAIDIXCOZAJ-LHEWISCISA-N