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1,3-Piperidinedicarboxylicacid, 3-amino-, 1-(1,1-dimethylethyl) ester (368866-17-5)

Identification
Name:1,3-Piperidinedicarboxylicacid, 3-amino-, 1-(1,1-dimethylethyl) ester
Synonyms:1-(tert-Butoxycarbonyl)-3-(carboxy)-3-aminopiperidine;
CAS:368866-17-5
Molecular Formula: C11H20N2O4
Molecular Weight: 244.29
InChI: InChI=1/C6H4N2O/c7-2-5-1-6(9)4-8-3-5/h1,3-4,9H
Molecular Structure: (C11H20N2O4) 1-(tert-Butoxycarbonyl)-3-(carboxy)-3-aminopiperidine;
Properties
Density:1.332g/cm3
Refractive index:1.595
Specification:

This chemical is called 1-Boc-3-Aminopiperidine-3-carboxylic acid, and its IUPAC name is 3-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid. With the molecular formula of C11H20N2O4, its molecular weight is 244.29. The CAS registry number of this chemical is 368866-17-5.

Other characteristics of the 1-Boc-3-Aminopiperidine-3-carboxylic acid can be summarised as followings: (1)ACD/LogP: 0.47; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 6; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 92.86 Å2; (7)Index of Refraction: 1.513; (8)Molar Refractivity: 61 cm3; (9)Molar Volume: 202.9 cm3; (10)Polarizability: 24.18×10-24cm3; (11)Surface Tension: 49.1 dyne/cm; (12)Density: 1.203 g/cm3; (13)Flash Point: 183.7 °C; (14)Enthalpy of Vaporization: 68.98 kJ/mol; (15)Boiling Point: 380.1 °C at 760 mmHg; (16)Vapour Pressure: 7.87E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: CC(C)(C)OC(=O)N1CCCC(C1)(C(=O)O)N
2.InChI: InChI=1/C11H20N2O4/c1-10(2,3)17-9(16)13-6-4-5-11(12,7-13)8(14)15/h4-7,12H2,1-3H3,(H,14,15)
3.InChIKey: OSYGMOYBKKZJES-UHFFFAOYAK
4.Std. InChI: InChI=1S/C11H20N2O4/c1-10(2,3)17-9(16)13-6-4-5-11(12,7-13)8(14)15/h4-7,12H2,1-3H3,(H,14,15)
5.Std. InChIKey: OSYGMOYBKKZJES-UHFFFAOYSA-N

Safety Data
 

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