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220243-56-1

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Basic Information
CAS No.: 220243-56-1
Name: TERT-BUTYL 2-(TERT-BUTOXYCARBONYLAMINO)-4-(OXIRAN-2-YL)BUTANOATE
Article Data: 2
Molecular Structure:
Molecular Structure of 220243-56-1 (TERT-BUTYL 2-(TERT-BUTOXYCARBONYLAMINO)-4-(OXIRAN-2-YL)BUTANOATE)
Formula: C15H27NO5
Molecular Weight: 301.383
Synonyms: tert-Butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate;Hexonic acid, 5,6-anhydro-2,3,4-trideoxy-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester;
Density: 1.077 g/cm3
Boiling Point: 395.4 °C at 760 mmHg
Flash Point: 192.9 °C
PSA: 77.16000
LogP: 2.79130
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Specification

The CAS register number of tert-Butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate is 220243-56-1. It also can be called as Hexonic acid, 5,6-anhydro-2,3,4-trideoxy-2-[[(1,1-dimethylethoxy)carbonyl]amino]-, 1,1-dimethylethyl ester and the systematic name about this chemical is tert-butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate. The molecular formula about this chemical is C15H27NO5 and molecular weight is 301.38.

Physical properties about tert-Butyl 2-(tert-butoxycarbonylamino)-4-(oxiran-2-yl)butanoate are: (1)ACD/LogP: 3.23; (2)ACD/LogD (pH 5.5): 3.23; (3)ACD/LogD (pH 7.4): 3.23; (4)#H bond acceptors: 6; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 9; (7)Polar Surface Area: 77.16Å2; (8)Index of Refraction: 1.47; (9)Molar Refractivity: 78.15 cm3; (10)Molar Volume: 279.6 cm3; (11)Polarizability: 30.98x10-24cm3; (12)Surface Tension: 37.3 dyne/cm; (13)Enthalpy of Vaporization: 64.56 kJ/mol; (14)Boiling Point: 395.4 °C at 760 mmHg; (15)Vapour Pressure: 1.84E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)C(CCC1CO1)NC(=O)OC(C)(C)C
(2)InChI: InChI=1/C15H27NO5/c1-14(2,3)20-12(17)11(8-7-10-9-19-10)16-13(18)21-15(4,5)6/h10-11H,7-9H2,1-6H3,(H,16,18)
(3)InChIKey: PDHCFJNTCGVWMN-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C15H27NO5/c1-14(2,3)20-12(17)11(8-7-10-9-19-10)16-13(18)21-15(4,5)6/h10-11H,7-9H2,1-6H3,(H,16,18)
(5)Std. InChIKey: PDHCFJNTCGVWMN-UHFFFAOYSA-N