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205584-67-4

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Basic Information
CAS No.: 205584-67-4
Name: 6-chloro-5-fluoro-2,3-dihydro-1H-indole
Molecular Structure:
Molecular Structure of 205584-67-4 (6-chloro-5-fluoro-2,3-dihydro-1H-indole)
Formula: C8H7ClFN
Molecular Weight: 171.602
Synonyms: 6-Chloro-5-fluoroindoline;6-chloro-5-fluoro-2,3-dihydro-1H-indole;
Density: 1.313 g/cm3
Boiling Point: 249.987 °C at 760 mmHg
Flash Point: 104.989 °C
PSA: 12.03000
LogP: 2.58510
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Specification

The CAS register number of 1H-Indole,6-chloro-5-fluoro-2,3-dihydro- is 205584-67-4. It also can be called as 6-Chlor-5-fluorindolin and the systematic name about this chemical is 6-chloro-5-fluoro-2,3-dihydro-1H-indole. The molecular formula about this chemical is C8H7ClFN and the molecular weight is 171.5993.

Physical properties about 1H-Indole,6-chloro-5-fluoro-2,3-dihydro- are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 183; (5)ACD/BCF (pH 7.4): 193; (6)ACD/KOC (pH 5.5): 1425; (7)ACD/KOC (pH 7.4): 1504; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)Polar Surface Area: 12.03Å2; (11)Index of Refraction: 1.557; (12)Molar Refractivity: 42.052 cm3; (13)Molar Volume: 130.718 cm3; (14)Polarizability: 16.671x10-24cm3; (15)Surface Tension: 40.256 dyne/cm; (16)Flash Point: 104.989 °C; (17)Enthalpy of Vaporization: 48.724 kJ/mol; (18)Boiling Point: 249.987 °C at 760 mmHg; (19)Vapour Pressure: 0.022 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc2CCNc2cc1Cl
(2)InChI: InChI=1/C8H7ClFN/c9-6-4-8-5(1-2-11-8)3-7(6)10/h3-4,11H,1-2H2
(3)InChIKey: RVYDZMQIYQISAU-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H7ClFN/c9-6-4-8-5(1-2-11-8)3-7(6)10/h3-4,11H,1-2H2
(5)Std. InChIKey: RVYDZMQIYQISAU-UHFFFAOYSA-N