1(2H)-Naphthalenone,8-fluoro-3,4-dihydro- supplier

Name
8-FLUORO-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE
EINECS
CAS No. 628731-58-8
Article Data8
CAS DataBase
Density 1.198 g/cm³
Solubility
Melting Point
Formula C₁₀H₉FO
Boiling Point 267.8 °C at 760 mmHg
Molecular Weight 164.179
Flash Point 101.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 8-Fluoro-3,4-dihydro-2H-naphthalen-1-one;
PSA 17.07000
LogP 2.34470

1(2H)-Naphthalenone,8-fluoro-3,4-dihydro- Specification

The 1(2H)-Naphthalenone,8-fluoro-3,4-dihydro-, with the CAS registry number 628731-58-8, is also known as Dibutylammonium chloride. It belongs to the product category of Halide. This chemical's molecular formula is C₁₀H₉FO and molecular weight is 164.18. What's more, its systematic name is 8-fluoro-3,4-dihydronaphthalen-1(2H)-one.

Physical properties of 1(2H)-Naphthalenone,8-fluoro-3,4-dihydro- are: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 2.66; (5)ACD/BCF (pH 5.5): 62.34; (6)ACD/BCF (pH 7.4): 62.34; (7)ACD/KOC (pH 5.5): 670.37; (8)ACD/KOC (pH 7.4): 670.37; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.542; (14)Molar Refractivity: 43.16 cm³; (15)Molar Volume: 136.9 cm³; (16)Polarizability: 17.11×10^-24cm³; (17)Surface Tension: 40.3 dyne/cm; (18)Density: 1.198 g/cm³; (19)Flash Point: 101.9 °C; (20)Enthalpy of Vaporization: 50.59 kJ/mol; (21)Boiling Point: 267.8 °C at 760 mmHg; (22)Vapour Pressure: 0.00798 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc2cccc1c2C(=O)CCC1
(2)InChI: InChI=1S/C10H9FO/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1,3,5H,2,4,6H2
(3)InChIKey: RYMWBQHSBRCBQV-UHFFFAOYSA-N

Product Name

8-FLUORO-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE

1(2H)-Naphthalenone,8-fluoro-3,4-dihydro- Specification

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