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  • 4-fluorobenzophenone
Name:4-fluorobenzophenone
CAS No:345-83-5

PRODUCT DESCRIPTION

【Name】
4-fluorobenzophenone
【Iupac name】
(4-fluorophenyl)-phenylmethanone
【CAS Registry number】
345-83-5
【Synonyms】
(4-Fluorophenyl)(phenyl)methanone
(4-Fluorophenyl)phenyl-methanone
p-fluorobenzophenone
【EINECS(EC#)】
206-463-7
【Molecular Formula】
C13H9FO (Products with the same molecular formula)
【Molecular Weight】
200.21
【Inchi】
InChI=1/C13H9FO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H
【InChIKey】
OGTSHGYHILFRHD-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)F
【MOL File】
345-83-5.mol

Chemical and Physical Properties

【Appearance】
white to yellow crystals
【Density】
130
【Melting Point】
46-50℃
【Boiling Point】
159-161℃ (13 torr)
【Refractive Index】
1.566
【Flash Point】
73 C
【Water】
Insoluble AUTOIGNITION
【Solubilities】
Insoluble AUTOIGNITION
【Stability】
Stable under normal temperatures and pressures.
【Storage temp】
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
【Computed Properties】
Molecular Weight:200.208363 [g/mol]
Molecular Formula:C13H9FO
XLogP3:3.5
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:2
Exact Mass:200.063743
MonoIsotopic Mass:200.063743
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Formal Charge:0
Complexity:213
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:1
Feature 3D Ring Count:2
Effective Rotor Count:2
Conformer Sampling RMSD:0.6
CID Conformer Count:1

Safety and Handling

【Hazard Codes】
Xi:Irritant;
【Risk Statements】
R36/37/38
【Safety Statements 】
S24/25
【HazardClass】
IRRITANT
【Hazard Note】
Irritant
【Safety】

Hazard Codes: IrritantXi 
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin 
Safety Statements: 26-37/39-24/25-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
S37/39: Wear suitable gloves and eye/face protection
S24/25: Avoid contact with skin and eyes 
S36: Wear suitable protective clothing
WGK Germany: 3
Hazard Note: Irritant

【Transport】
25kgs
【Specification】

 4-Fluorobenzophenone (CAS NO.345-83-5) is also called p-Fluorobenzophenone ; Methanone, (4-fluorophenyl)phenyl-;4-fluorobenzophenone ; (4-fFuorophenyl)(phenyl)methanone ; Labotest-bb LT00159548 ; para-Fluorobenzophenone .

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