4-Fluoro-2,3-dihydro-1H-indole hydrochloride supplier

Name
4-FLUORO-2,3-DIHYDRO-1H-INDOLE HYDROCHLORIDE
EINECS
CAS No. 552866-98-5
Article Data17
CAS DataBase
Density 1.154 g/cm³
Solubility
Melting Point
Formula C₈H₈FN
Boiling Point 215.7 °C at 760 mmHg
Molecular Weight 137.157
Flash Point 84.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Fluoroindoline;4-fluoro-2,3-dihydro-1H-indole;
PSA 12.03000
LogP 1.93170

4-Fluoro-2,3-dihydro-1H-indole hydrochloride Specification

The 1H-Indole,4-fluoro-2,3-dihydro-, with the CAS registry number 552866-98-5, has the systematic name of 4-fluoro-2,3-dihydro-1H-indole. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₈H₈FN.

The characteristics of 1H-Indole,4-fluoro-2,3-dihydro- are as followings: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.09; (4)ACD/LogD (pH 7.4): 2.11; (5)ACD/BCF (pH 5.5): 22.36; (6)ACD/BCF (pH 7.4): 23.7; (7)ACD/KOC (pH 5.5): 316.38; (8)ACD/KOC (pH 7.4): 335.43; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: Å²; (13)Index of Refraction: 1.538; (14)Molar Refractivity: 37.15 cm³; (15)Molar Volume: 118.7 cm³; (16)Polarizability: 14.73×10^-24cm³; (17)Surface Tension: 37.2 dyne/cm; (18)Density: 1.154 g/cm³; (19)Flash Point: 84.2 °C; (20)Enthalpy of Vaporization: 45.2 kJ/mol; (21)Boiling Point: 215.7 °C at 760 mmHg; (22)Vapour Pressure: 0.146 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Fc1cccc2c1CCN2
(2)InChI: InChI=1/C8H8FN/c9-7-2-1-3-8-6(7)4-5-10-8/h1-3,10H,4-5H2
(3)InChIKey: CMQOXZRRFDMQKY-UHFFFAOYAP

Product Name

4-FLUORO-2,3-DIHYDRO-1H-INDOLE HYDROCHLORIDE

4-Fluoro-2,3-dihydro-1H-indole hydrochloride Specification

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