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94500-78-4

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Basic Information
CAS No.: 94500-78-4
Name: ethyl 2-(bis(benzenesulfonyl)amino)acetate
Molecular Structure:
Molecular Structure of 94500-78-4 (ethyl 2-(bis(benzenesulfonyl)amino)acetate)
Formula: C16H17NO6S2
Molecular Weight: 383.446
Synonyms: NSC49228;
Density: 1.381 g/cm3
Boiling Point: 542.6 °C at 760 mmHg
Flash Point: 281.9 °C
PSA: 114.58000
LogP: 3.79090
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    Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester

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    Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester

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    94500-78-4

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  • Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester cas 94500-78-4

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    Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester cas 94500-78-4

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  • ethyl 2-(bis(benzenesulfonyl)amino)acetate

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    ethyl 2-(bis(benzenesulfonyl)amino)acetate

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Specification

The Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester is an organic compound with the formula C16H17NO6S2. With the CAS registry number 94500-78-4, the systematic/IUPAC name of this chemical is ethyl 2-[bis(benzenesulfonyl)amino]acetate.

Physical properties about Glycine,N,N-bis(phenylsulfonyl)-, ethyl ester are: (1)ACD/LogP: 2.54; (2)#H bond acceptors: 7; (3)#Freely Rotating Bonds: 8; (4)Polar Surface Area: 114.58 Å2; (5)Index of Refraction: 1.587; (6)Molar Refractivity: 93.36 cm3; (7)Molar Volume: 277.6 cm3; (8)Polarizability: 37.01×10-24cm3; (9)Surface Tension: 52.9 dyne/cm; (10)Density: 1.381 g/cm3; (11)Flash Point: 281.9 °C; (12)Enthalpy of Vaporization: 82.07 kJ/mol; (13)Boiling Point: 542.6 °C at 760 mmHg; (14)Vapour Pressure: 7.79E-12 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(N(CC(=O)OCC)S(=O)(=O)c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C16H17NO6S2/c1-2-23-16(18)13-17(24(19,20)14-9-5-3-6-10-14)25(21,22)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
(3)InChIKey: JPYKCMNCESLVOL-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C16H17NO6S2/c1-2-23-16(18)13-17(24(19,20)14-9-5-3-6-10-14)25(21,22)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3
(5)Std. InChIKey: JPYKCMNCESLVOL-UHFFFAOYSA-N