CAS No.56538-57-9,2-([(Benzyloxy)carbonyl]amino)-2-hydroxyacetic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	56538-57-9
Name:	2-([(Benzyloxy)carbonyl]amino)-2-hydroxyacetic acid
Article Data:	31

Formula:	C₁₀H₁₁NO₅
Molecular Weight:	225.20
Synonyms:	Acetic acid, 2-hydroxy-2-[[(phenylmethoxy)carbonyl]amino]-;{[(Benzyloxy)carbonyl]amino}(hydroxy)acetic acid;
Density:	1.406 g/cm³
Melting Point:	120-121℃
Boiling Point:	470.3 °C at 760 mmHg
Flash Point:	238.2 °C
PSA:	95.86000
LogP:	0.70670

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Specification

The 2-([(Benzyloxy)carbonyl]amino)-2-hydroxyacetic acid, with the CAS registry number 56538-57-9, is also known as Acetic acid, 2-hydroxy-2-[[(phenylmethoxy)carbonyl]amino]-. This chemical's molecular formula is C₁₀H₁₁NO₅ and molecular weight is 225.20. What's more, its IUPAC name is 2-hydroxy-2-(phenylmethoxycarbonylamino)acetic acid.

Physical properties of 2-([(Benzyloxy)carbonyl]amino)-2-hydroxyacetic acid are: (1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.02; (4)ACD/LogD (pH 7.4): -2.69; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 65.07 Å²; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 53.49 cm³; (15)Molar Volume: 160 cm³; (16)Polarizability: 21.×10^-24cm³; (17)Surface Tension: 63.6 dyne/cm; (18)Density: 1.406 g/cm³; (19)Flash Point: 238.2 °C; (20)Enthalpy of Vaporization: 77.2 kJ/mol; (21)Boiling Point: 470.3 °C at 760 mmHg; (22)Vapour Pressure: 1.2E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C(O)NC(=O)OCc1ccccc1
(2)InChI: InChI=1/C10H11NO5/c12-8(9(13)14)11-10(15)16-6-7-4-2-1-3-5-7/h1-5,8,12H,6H2,(H,11,15)(H,13,14)
(3)InChIKey: JQEZLSUFDXSIEK-UHFFFAOYAF