N-tert-Butoxycarbonyl-1,6-hexanediamine supplier

Name
N-tert-Butoxycarbonyl-1,6-hexanediamine
EINECS -0
CAS No. 51857-17-1
Article Data109
CAS DataBase
Density 0.965 g/cm³
Solubility
Melting Point
Formula C₁₁H₂₄N₂O₂
Boiling Point 106-110 °C (0.3 mmHg)
Molecular Weight 216.324
Flash Point 125 °C
Transport Information UN 2735
Appearance off-white solid
Safety 26-36/37/39-45
Risk Codes 34
Molecular Structure
Hazard Symbols C
Synonyms Carbamicacid, (6-aminohexyl)-, 1,1-dimethylethyl ester (9CI);(6-Aminohexyl)carbamicacid tert-butyl ester;1-((tert-Butoxycarbonyl)amino)-6-aminohexane;6-((tert-Butoxycarbonyl)amino)-1-hexylamine;6-(tert-Butoxycarbonylamino)-1-hexanamine;6-Aminohexylcarbamic acid tert-butylester;6-[(tert-Butyloxycarbonyl)amino]hexylamine;N-(tert-Butoxycarbonyl)-1,6-hexanediamine;N-(tert-Butoxycarbonyl)hexamethylenediamine;N-BOC-1,6-diaminohexane;tert-Butyl (6-aminohexyl)carbamate;tert-Butyl N-(6-aminohexyl)carbamate;
PSA 64.35000
LogP 3.12140

N-tert-Butoxycarbonyl-1,6-hexanediamine Specification

This chemical is called Carbamic acid, N-(6-aminohexyl)-, 1,1-dimethylethyl ester, and its systematic name is tert-butyl (6-aminohexyl)carbamate. With the molecular formula of C₁₁H₂₄N₂O₂, its molecular weight is 216.32. The CAS registry number of this chemical is 51857-17-1. Additionally, its product categories are All Aliphatics; Monoprotected Diaminoalkanes; N-Boc-diaminoalkanes; Aliphatics; Amines.

Other characteristics of the Carbamic acid, N-(6-aminohexyl)-, 1,1-dimethylethyl ester can be summarised as followings: (1)ACD/LogP: 1.82; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.27; (4)ACD/LogD (pH 7.4): -1.03; (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: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 32.78 Å²; (13)Index of Refraction: 1.459; (14)Molar Refractivity: 61.88 cm³; (15)Molar Volume: 226.1 cm³; (16)Polarizability: 24.53×10^-24cm³; (17)Surface Tension: 34.1 dyne/cm; (18)Density: 0.956 g/cm³; (19)Flash Point: 150.5 °C; (20)Enthalpy of Vaporization: 56.74 kJ/mol; (21)Boiling Point: 325.3 °C at 760 mmHg; (22)Vapour Pressure: 0.000233 mmHg at 25°C.

Uses of this chemical: The Carbamic acid, N-(6-aminohexyl)-, 1,1-dimethylethyl ester could react with carbonyl dichloride, and obtain the 1,3-Bis[6-(Boc-amino)hexyl]urea. This reaction needs the reagent of triethylamine, and the solvent of toluene. The yield is 65 %.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. You should wear suitable protective clothing to avoid contacting with skin and eyes. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OC(C)(C)C)NCCCCCCN
2.InChI: InChI=1/C11H24N2O2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8-12/h4-9,12H2,1-3H3,(H,13,14)
3.InChIKey: RVZPDKXEHIRFPM-UHFFFAOYAB

Product Name

N-tert-Butoxycarbonyl-1,6-hexanediamine

N-tert-Butoxycarbonyl-1,6-hexanediamine Specification

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