Tributylpentylammon...

Tributylpentylammonium bromide 99% supplier in China

Tributylpentylammonium bromide 99% supplier in China

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1 Kilogram

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  • Min.Order :1 Kilogram
  • Purity: 99%
  • Payment Terms : L/C,T/T

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  • Appearance:powder
  • Application:fine chemical
  • PackAge:25kg
  • ProductionCapacity:|Metric Ton|Day
  • Storage:room temperature
  • Transportation:by air or by sea

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1. Introduction of Tributylpentylammonium bromide

Tributylpentylammonium bromide, with the CAS registry number 37026-92-9 and EINECS registry number 253-314-7, has the systematic name of 5-butyl-6-propyldecan-5-aminium bromide. It is also called tributyl(pentyl)azanium bromide. And the molecular formula of the chemical is C17H38BrN.

2. Basic Information of Tributylpentylammonium bromide


1). Properties of Tributylpentylammonium bromide

The characteristics of Tributylpentylammonium bromide are as followings: (1)ACD/LogP: 7.29; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.19; (4)ACD/LogD (pH 7.4): 4.26; (5)ACD/BCF (pH 5.5): 161.97; (6)ACD/BCF (pH 7.4): 190.45; (7)ACD/KOC (pH 5.5): 174.72; (8)ACD/KOC (pH 7.4): 205.44; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 0 ?2; (13)Flash Point: 141.9 °C; (14)Enthalpy of Vaporization: 55.8 kJ/mol; (15)Boiling Point: 316.7 °C at 760 mmHg; (16)Vapour Pressure: 0.000404 mmHg at 25°C. 


2). Descriptors of Structure

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Br-].C(CCC(C(CCCC)CCC)([NH3+])CCCC)C
(2)InChI: InChI=1/C17H37N.BrH/c1-5-9-13-16(12-8-4)17(18,14-10-6-2)15-11-7-3;/h16H,5-15,18H2,1-4H3;1H
(3)InChIKey: WDUAVSCFOSZZOD-UHFFFAOYAT

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