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  • Methanone,[1,1-biphenyl]-4-ylphenyl
Name:Methanone,[1,1-biphenyl]-4-ylphenyl
CAS No:2128-93-0

PRODUCT DESCRIPTION

【Name】
Methanone,[1,1'-biphenyl]-4-ylphenyl-
【Iupac name】
phenyl-(4-phenylphenyl)methanone
【CAS Registry number】
2128-93-0
【Synonyms】
Benzophenone,4-phenyl- (6CI,7CI,8CI)
(Biphenyl-4-yl)(phenyl)methanone
4-(Phenylcarbonyl)biphenyl
4-Biphenylyl phenyl ketone
4-Phenylbenzophenone
4-Phenylphenyl phenyl methanone
Eusolex 3490
GenocurePBZ
NSC 55283
NSC 97365
Phenyl p-biphenylyl ketone
Speedcure BPZ
Trigonal12
p-Benzoylbiphenyl
p-Biphenylyl phenyl ketone
p-Phenylbenzophenone
【EINECS(EC#)】
218-345-2
【Molecular Formula】
C19H14O (Products with the same molecular formula)
【Molecular Weight】
258.31
【Inchi】
InChI=1/C19H14O/c20-19(17-9-5-2-6-10-17)18-13-11-16(12-14-18)15-7-3-1-4-8-15/h1-14H
【InChIKey】
LYXOWKPVTCPORE-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3
【MOL File】
2128-93-0.mol

Chemical and Physical Properties

【Appearance】
off white crystalline powder
【Density】
1.266g/cm3
【Melting Point】
99-103℃
【Boiling Point】
419-420℃
【Vapour】
3.11E-07mmHg at 25°C
【Refractive Index】
1.609
【Flash Point】
190.7°C
【Solubilities】
Appearance:off white crystalline powder
Transport Information:25kgs 
Hazard Symbols:UN NO.
Safety:S24/25
【Stability】
Stable under normal temperatures and pressures.
【Storage temp】
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
【Computed Properties】
Molecular Weight:258.31386 [g/mol]
Molecular Formula:C19H14O
XLogP3-AA:4.9
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:3
Exact Mass:258.104465
MonoIsotopic Mass:258.104465
Topological Polar Surface Area:17.1
Heavy Atom Count:20
Formal Charge:0
Complexity:302
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:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:2

Safety and Handling

【Hazard Codes】
UN NO.
【Risk Statements】
R20/21/22
【Safety Statements 】
S24/25
【Hazard Note】

Irritant

【Transport】
25kgs

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