tert-Butyl piperazin-1-ylcarbamate supplier

Name
tert-butyl piperazin-1-ylcarbamate
EINECS
CAS No. 147081-80-9
Density 1.08 g/cm³
Solubility
Melting Point
Formula C₉H₁₉N₃O₂
Boiling Point
Molecular Weight 201.269
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms tert-Butyl1-piperazinylcarbamate;
PSA 53.60000
LogP 0.98890

tert-Butyl piperazin-1-ylcarbamate Specification

The tert-Butyl piperazin-1-ylcarbamate, with cas registry number 147081-80-9, has the systematic name of tert-butyl piperazin-1-ylcarbamate. And it is also called carbamic acid, N-1-piperazinyl-, 1,1-dimethylethyl ester.

Physical properties about this chemical are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 2.09; (6)#H bond acceptors: 5; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 53.6 Å²; (10)Index of Refraction: 1.504; (11)Molar Refractivity: 54.71 cm³; (12)Molar Volume: 184.7 cm³; (13)Polarizability: 21.69×10^-24cm³; (14)Surface Tension: 40.3 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)(C)OC(=O)NN1CCNCC1
(2)InChI: InChI=1/C9H19N3O2/c1-9(2,3)14-8(13)11-12-6-4-10-5-7-12/h10H,4-7H2,1-3H3,(H,11,13)
(3)InChIKey: MHKPBRDUFKYAGW-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C9H19N3O2/c1-9(2,3)14-8(13)11-12-6-4-10-5-7-12/h10H,4-7H2,1-3H3,(H,11,13)
(5)Std. InChIKey: MHKPBRDUFKYAGW-UHFFFAOYSA-N

Product Name

tert-butyl piperazin-1-ylcarbamate

tert-Butyl piperazin-1-ylcarbamate Specification

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