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Name |
Benzaldehyde,4-chloro-3-fluoro-, oxime |
EINECS | N/A |
CAS No. | 202925-09-5 | Density | 1.327 g/cm3 |
PSA | 32.59000 | LogP | 2.28720 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H5ClFNO | Boiling Point | 240.448 °C at 760 mmHg |
Molecular Weight | 173.574 | Flash Point | 99.22 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-Chloro-3-fluorobenzaldoxime; |
Article Data | 10 |
The Benzaldehyde,4-chloro-3-fluoro-, oxime, with the CAS registry number 202925-09-5, is also known as 4-Chloro-3-fluorobenzaldoxime. This chemical's molecular formula is C7H5ClFNO and molecular weight is 173.57. What's more, its IUPAC name is 3-[2-(2-hydroxyethyl)piperidin-1-yl]-N-[4-[3-[2-(2-hydroxyethyl)piperidin-1-yl]propanoylamino]-9,10-dioxoanthracen-1-yl]propanamide. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about Benzaldehyde,4-chloro-3-fluoro-, oxime are: (1)ACD/LogP: 2.99; (2) # of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 117; (6)ACD/BCF (pH 7.4): 117; (7)ACD/KOC (pH 5.5): 1055; (8)ACD/KOC (pH 7.4): 1055; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 32.59 Å2; (13)Index of Refraction: 1.533; (14)Molar Refractivity: 40.63 cm3; (15)Molar Volume: 130.814 cm3; (16)Polarizability: 16.107×10-24 cm3; (17)Surface Tension: 37.756 dyne/cm; (18) Density: 1.327 g/cm3; (19)Flash Point: 99.22 °C; (20)Enthalpy of Vaporization: 50.446 kJ/mol; (21)Boiling Point: 240.448 °C at 760 mmHg; (22)Vapour Pressure: 0.021 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(\C=N\O)ccc1Cl
(2)InChI: InChI=1/C7H5ClFNO/c8-6-2-1-5(4-10-11)3-7(6)9/h1-4,11H/b10-4+
(3)InChIKey: OMBFOEPKXLLRRV-ONNFQVAWBZ