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169396-88-7

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Basic Information
CAS No.: 169396-88-7
Name: N-[2-(FMOC-AMINO)-ETHYL]GLYCINE TERT-BUTYL ESTER HYDROCHLORIDE
Article Data: 8
Molecular Structure:
Molecular Structure of 169396-88-7 (N-[2-(FMOC-AMINO)-ETHYL]GLYCINE TERT-BUTYL ESTER HYDROCHLORIDE)
Formula: C23H29ClN2O4
Molecular Weight: 432.947
Synonyms: Glycine,N-[2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]ethyl]-, 1,1-dimethylethyl ester,monohydrochloride (9CI);
Boiling Point: 582.5 °C at 760 mmHg
Flash Point: 306.1 °C
PSA: 76.66000
LogP: 5.04020
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Specification

The Glycine,N-[2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]ethyl]-, 1,1-dimethylethyl ester,hydrochloride (1:1), with CAS registry number 169396-88-7, has the systematic name of tert-butyl N-(2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}ethyl)glycinate hydrochloride. This chemical should be stored at the temperature of 2-8°C. And the chemical formula of this chemical is C23H29ClN2O4.

Physical properties of Glycine,N-[2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]ethyl]-, 1,1-dimethylethyl ester,hydrochloride (1:1): (1)ACD/LogP: 4.85; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 10; (6)Polar Surface Area: 59.08 Å2; (7)Flash Point: 306.1 °C; (8)Enthalpy of Vaporization: 88.7 kJ/mol; (9)Boiling Point: 582.5 °C at 760 mmHg; (10)Vapour Pressure: 7.28E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(OC(C)(C)C)CNCCNC(=O)OCC3c1ccccc1c2c3cccc2
(2)InChI: InChI=1/C23H28N2O4.ClH/c1-23(2,3)29-21(26)14-24-12-13-25-22(27)28-15-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20;/h4-11,20,24H,12-15H2,1-3H3,(H,25,27);1H
(3)InChIKey: LVIQOMHZCMGMIG-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C23H28N2O4.ClH/c1-23(2,3)29-21(26)14-24-12-13-25-22(27)28-15-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20;/h4-11,20,24H,12-15H2,1-3H3,(H,25,27);1H
(5)Std. InChIKey: LVIQOMHZCMGMIG-UHFFFAOYSA-N