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2H-Indeno[5,4-b]furan-8-ethanamine,1,6,7,8-tetrahydro- (448964-37-2)

Identification
Name:2H-Indeno[5,4-b]furan-8-ethanamine,1,6,7,8-tetrahydro-
Synonyms:2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-ethanamine;2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-yl-ethylamine;rac Despropionyl Ramelteon Discontinued see: D297275
CAS:448964-37-2
Molecular Formula: C13H17NO
Molecular Weight: 203.28
InChI: InChI=1/C13H17NO/c14-7-5-10-2-1-9-3-4-12-11(13(9)10)6-8-15-12/h3-4,10H,1-2,5-8,14H2
Molecular Structure: (C13H17NO) 2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-ethanamine;2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-yl-...
Properties
Density:1.12g/cm3
Refractive index:1.587
Specification:

The 2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-ylethylamine, with CAS registry number 448964-37-2, belongs to the following product categories: (1)Amines; (2)Aromatics; (3)Heterocycles. It has the systematic name of 2H-indeno[5,4-b]furan-8-amine, N-ethyl-1,6,7,8-tetrahydro-. Besides this, it is also called N-Ethyl-1,6,7,8-tetrahydro-2H-indeno[5,4-b]furan-8-amine. And this chemical is a kind of colorless oil.

Physical properties of 2,6,7,8-Tetrahydro-1H-indeno[5,4-b]furan-8-ylethylamine: (1)ACD/LogP: 2.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.16; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 3.08; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 21.26 Å2; (12)Index of Refraction: 1.583; (13)Molar Refractivity: 60.42 cm3; (14)Molar Volume: 180.7 cm3; (15)Polarizability: 23.95×10-24cm3; (16)Surface Tension: 44.2 dyne/cm; (17)Enthalpy of Vaporization: 55.86 kJ/mol; (18)Vapour Pressure: 0.000391 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCNC1CCc2c1c3c(cc2)OCC3
(2)InChI: InChI=1/C13H17NO/c1-2-14-11-5-3-9-4-6-12-10(13(9)11)7-8-15-12/h4,6,11,14H,2-3,5,7-8H2,1H3
(3)InChIKey: KOTMXKCFVRQXCL-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C13H17NO/c1-2-14-11-5-3-9-4-6-12-10(13(9)11)7-8-15-12/h4,6,11,14H,2-3,5,7-8H2,1H3
(5)Std. InChIKey: KOTMXKCFVRQXCL-UHFFFAOYSA-N

Usage:A tricyclic indan derivative; as potential therapeutic agent for sleep disorders
Safety Data
 

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