3-Benzofuranethanamine supplier

Name
2-BENZO[B]FURAN-3-YLETHYLAMINE
EINECS
CAS No. 27404-31-5
Article Data18
CAS DataBase
Density 1.129 g/cm³
Solubility
Melting Point 183-185 °C
Formula C₁₀H₁₁NO
Boiling Point 268.529 °C at 760 mmHg
Molecular Weight 161.203
Flash Point 116.202 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(1-Benzofuran-3-yl)ethylamine;2-(3-Benzo[b]furanyl)ethylamine;2-(Benzofuran-3-yl)ethylamine;3-Benzofuranethylamine(8CI);
PSA 39.16000
LogP 2.63430

3-Benzofuranethanamine Specification

The 3-Benzofuranethanamine, with the CAS registry number 27404-31-5, is also known as 2-(3-Benzo[b]furanyl)ethylamine. This chemical's molecular formula is C₁₀H₁₁NO and molecular weight is 161.2. What's more, its IUPAC name is 2-(1-benzofuran-3-yl)ethanamine.

Physical properties of 3-Benzofuranethanamine are: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/KOC (pH 5.5): 1; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 39.16 Å²; (9)Index of Refraction: 1.609; (10)Molar Refractivity: 49.48 cm³; (11)Molar Volume: 142.839 cm³; (12)Surface Tension: 45.372 dyne/cm; (13)Density: 1.129 g/cm³; (14)Flash Point: 116.202 °C; (15)Enthalpy of Vaporization: 50.661 kJ/mol; (16)Boiling Point: 268.529 °C at 760 mmHg; (17)Vapour Pressure: 0.008 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C(=CO2)CCN
(2)InChI: InChI=1S/C10H11NO/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7H,5-6,11H2
(3)InChIKey: NEHYFMQXSNIAMZ-UHFFFAOYSA-N

Product Name

2-BENZO[B]FURAN-3-YLETHYLAMINE

3-Benzofuranethanamine Specification

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