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  • Methanone,(4-fluorophenyl)(4-methoxyphenyl)
Name:Methanone,(4-fluorophenyl)(4-methoxyphenyl)
CAS No:345-89-1

PRODUCT DESCRIPTION

【Name】
Methanone,(4-fluorophenyl)(4-methoxyphenyl)-
【Iupac name】
(4-fluorophenyl)-(4-methoxyphenyl)methanone
【CAS Registry number】
345-89-1
【Synonyms】
Benzophenone,4-fluoro-4'-methoxy- (6CI,8CI)
(4-Fluorophenyl)(4-methoxyphenyl)methanone
4,4'-Fluoromethoxybenzophenone
p-(4-Fluorobenzoyl)anisole
【EINECS(EC#)】
206-464-2
【Molecular Formula】
C14H11FO2 (Products with the same molecular formula)
【Molecular Weight】
230.24
【Inchi】
InChI=1/C14H11FO2/c1-17-13-8-4-11(5-9-13)14(16)10-2-6-12(15)7-3-10/h2-9H,1H3
【Canonical SMILES】
COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)F
【MOL File】
345-89-1.mol

Chemical and Physical Properties

【Appearance】
White to off White Crystalline Powder
【Density】
1.176 g/cm3
【Melting Point】
90-92ºC
【Boiling Point】
351.4 °C at 760 mmHg
【Refractive Index】
1.553
【Flash Point】
160.7 °C
【Computed Properties】
Molecular Weight:230.234343 [g/mol]
Molecular Formula:C14H11FO2
XLogP3:3.5
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:3
Exact Mass:230.074308
MonoIsotopic Mass:230.074308
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Formal Charge:0
Complexity:251
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Ring Count:2
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:5

Safety and Handling

【Risk Statements】
R36/37/38
【Safety Statements 】
26-36
【Hazard Note】
Irritant
【Safety】

Hazard Note: Irritant
Risk Statements about 4-Fluoro-4'-methoxybenzophenone (345-89-1):
    R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements about 4-Fluoro-4'-methoxybenzophenone (345-89-1):
    S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
    S36 Wear suitable protective clothing.

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