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3-Benzofuranethanamine

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Name

3-Benzofuranethanamine

EINECS N/A
CAS No. 27404-31-5 Density 1.129 g/cm3
PSA 39.16000 LogP 2.63430
Solubility N/A 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 N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 27404-31-5 (2-BENZO[B]FURAN-3-YLETHYLAMINE) Hazard Symbols N/A
Synonyms

2-(1-Benzofuran-3-yl)ethylamine;2-(3-Benzo[b]furanyl)ethylamine;2-(Benzofuran-3-yl)ethylamine;3-Benzofuranethylamine(8CI);

Article Data 18

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

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