Basic information
- Name:
2-Butyl-benzofuran-5-ylamine hydrochloride
- Superlist Name:
- 2-Butyl-5-benzofuranamine hydrochloride
- CAS No.:
526196-90-7
- Molecular Structure:
- Formula:
- C12H16ClNO
- Molecular Weight:
- 225.7145
- Boiling Point:
- 317.1 °C at 760 mmHg
- Flash Point:
- 145.6 °C
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The CAS registry number of 2-Butyl-benzofuran-5-ylamine hydrochloride is 526196-90-7. This chemical's molecular formula is C12H16ClNO and molecular weight is 225.7145. What's more, its systematic name is called 2-Butyl-1-benzofuran-5-amine hydrochloride (1:1).
Physical properties about 2-Butyl-benzofuran-5-ylamine hydrochloride are: (1)ACD/LogP: 3.44; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 237; (6)ACD/BCF (pH 7.4): 243; (7)ACD/KOC (pH 5.5): 1732; (8)ACD/KOC (pH 7.4): 1776; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 16.38 Å2; (13)Flash Point: 145.6 °C; (14)Enthalpy of Vaporization: 55.85 kJ/mol; (15)Boiling Point: 317.1 °C at 760 mmHg; (16)Vapour Pressure: 0.000392 mmHg at 25 °C .
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.o2c1ccc(cc1cc2CCCC)N
(2) InChI: InChI=1/C12H15NO.ClH/c1-2-3-4-11-8-9-7-10(13)5-6-12(9)14-11;/h5-8H,2-4,13H2,1H3;1H
(3) InChIKey: IPNAECRFGLADHK-UHFFFAOYAA
