tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate supplier

Name
1-Boc-4-(3-amino-6-bromopyrazin-2-yl)piperazine
EINECS
CAS No. 479685-13-7
Density 1.463 g/cm³
Solubility
Melting Point
Formula C₁₃H₂₀BrN₅O₂
Boiling Point 478.617 °C at 760 mmHg
Molecular Weight 358.24
Flash Point 243.259 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms tert-butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate;
PSA 84.58000
LogP 2.46250

tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate Specification

This chemical is called tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate, and it can also be named as 1-Boc-4-(3-amino-6-bromopyrazin-2-yl)piperazine. With the molecular formula of C₁₃H₂₀BrN₅O₂, its molecular weight is 358.24. The CAS registry number of this chemical is 479685-13-7.

Other characteristics of the tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate can be summarised as followings: (1)ACD/LogP: 3.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.648; (4)ACD/LogD (pH 7.4): 3.653; (5)ACD/BCF (pH 5.5): 347.592; (6)ACD/BCF (pH 7.4): 351.55; (7)ACD/KOC (pH 5.5): 2286.059; (8)ACD/KOC (pH 7.4): 2312.089; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 84.58 Å²; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 82.948 cm³; (15)Molar Volume: 244.857 cm³; (16)Polarizability: 32.883×10^-24cm³; (17)Surface Tension: 59.237 dyne/cm; (18)Density: 1.463 g/cm³; (19)Flash Point: 243.259 °C; (20)Enthalpy of Vaporization: 74.276 kJ/mol; (21)Boiling Point: 478.617 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: CC(C)(C)OC(=O)N1CCN(CC1)c2c(ncc(n2)Br)N
2.InChI: InChI=1/C13H20BrN5O2/c1-13(2,3)21-12(20)19-6-4-18(5-7-19)11-10(15)16-8-9(14)17-11/h8H,4-7H2,1-3H3,(H2,15,16)
3.InChIKey: LJDVAJMXKQFLJO-UHFFFAOYAG

Product Name

1-Boc-4-(3-amino-6-bromopyrazin-2-yl)piperazine

tert-Butyl 4-(3-amino-6-bromopyrazin-2-yl)piperazine-1-carboxylate Specification

Related Products

Hot Products