Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
6-Fluoro-4-oxo-4H-chromene-3-carbaldehyde |
EINECS | N/A |
CAS No. | 69155-76-6 | Density | 1.526 g/cm3 |
PSA | 47.28000 | LogP | 1.74460 |
Solubility | N/A | Melting Point |
155-160 °C(lit.) |
Formula | C10H5FO3 | Boiling Point | 313.7 °C at 760 mmHg |
Molecular Weight | 192.146 | Flash Point | 138.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
TIMTEC-BB SBB005562;AKOS BBS-00001397;6-FLUORO-4-OXO-4H-CHROMENE-3-CARBALDEHYDE;6-FLUOROCHROMONE-3-CARBOXALDEHYDE;6-FLUORO-3-FORMYLCHROMONE;6-FLUOROCHROMONE-3-CARBOXALDEHYDE 97% |
Article Data | 26 |
The 4H-1-Benzopyran-3-carboxaldehyde,6-fluoro-4-oxo-, with the CAS registry number of 69155-76-6, is also known as 6-Fluorochromone-3-carboxaldehyde. It belongs to the product category of Heterocyclic Compounds. Its molecular formula is C10H5FO3 and molecular weight is 192.14. What's more, its IUPAC name is 6-Fluoro-4-oxochromene-3-carbaldehyde.
Physical properties about the 4H-1-Benzopyran-3-carboxaldehyde,6-fluoro-4-oxo- are: (1)ACD/LogP: 1.15; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 43.37 Å2; (7)Index of Refraction: 1.658; (8)Molar Refractivity: 46.36 cm3; (9)Molar Volume: 125.8 cm3; (10)Surface Tension: 65.5 dyne/cm; (11)Density: 1.526 g/cm3; (12)Flash Point: 138.9 °C; (13)Enthalpy of Vaporization: 55.48 kJ/mol; (14)Boiling Point: 313.7 °C at 760 mmHg; (15)Vapour Pressure: 0.000489 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Fc2ccc1O/C=C(\C(=O)c1c2)C=O
(2) InChI: InChI=1/C10H5FO3/c11-7-1-2-9-8(3-7)10(13)6(4-12)5-14-9/h1-5H
(3) InChIKey: VHRMOTNEBIKURN-UHFFFAOYAD