Methyl N-Boc-2-(dimethylphosphono)glycinate supplier

Name
(+/-)-BOC-ALPHA-PHOSPHONOGLYCINE TRIMETHYL ESTER
EINECS
CAS No. 89524-98-1
Article Data17
CAS DataBase
Density 1.204 g/cm³
Solubility Insoluble in water.
Melting Point 67-71°C
Formula C₁₀H₂₀NO₇P
Boiling Point 398.6 °C at 760 mmHg
Molecular Weight 297.245
Flash Point 194.9 °C
Transport Information
Appearance
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols T
Synonyms Aceticacid, (dimethoxyphosphinyl)[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester(9CI);Methyl 2-[(tert-butoxycarbonyl)amino]-2-(dimethoxyphosphoryl)acetate;
PSA 109.97000
LogP 1.88700

Methyl N-Boc-2-(dimethylphosphono)glycinate Specification

The cas register number of Methyl N-Boc-2-(dimethylphosphono)glycinate is 89524-98-1. It also can be called as (Dimethoxyphosphinyl)-{[(1,1-dimethylethoxy)-carbonyl]-amino}-acetic acid methyl ester and the Systematic name about this chemical is methyl 2-dimethoxyphosphoryl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate.

Physical properties about Methyl N-Boc-2-(dimethylphosphono)glycinate are: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.39; (4)ACD/LogD (pH 7.4): 1.39; (5)ACD/BCF (pH 5.5): 6.68; (6)ACD/BCF (pH 7.4): 6.64; (7)ACD/KOC (pH 5.5): 135.52; (8)ACD/KOC (pH 7.4): 134.74; (9)#H bond acceptors: 8; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 101.18Å²; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 65.81 cm³; (15)Molar Volume: 246.6 cm³; (16)Surface Tension: 37.7 dyne/cm; (17)Density: 1.204 g/cm³; (18)Flash Point: 194.9 °C; (19)Enthalpy of Vaporization: 64.92 kJ/mol; (20)Boiling Point: 398.6 °C at 760 mmHg; (21)Vapour Pressure: 1.46E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is toxic if swallowed. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

People can use the following data to convert to the molecule structure.
1.SMILES: O=P(OC)(OC)C(NC(=O)OC(C)(C)C)C(=O)OC
2.InChI: InChI=1/C10H20NO7P/c1-10(2,3)18-9(13)11-7(8(12)15-4)19(14,16-5)17-6/h7H,1-6H3,(H,11,13)
3.InChIKey: LJHAPRKTPAREGO-UHFFFAOYAR
4.Std. InChI: InChI=1S/C10H20NO7P/c1-10(2,3)18-9(13)11-7(8(12)15-4)19(14,16-5)17-6/h7H,1-6H3,(H,11,13)

Product Name

(+/-)-BOC-ALPHA-PHOSPHONOGLYCINE TRIMETHYL ESTER

Methyl N-Boc-2-(dimethylphosphono)glycinate Specification

Related Products

Hot Products