Benzophenone, 2-methyl-4'-phenyl-
Basic information
- CAS
85296-08-8- Standard SMILES
Cc1ccccc1C(=O)c1ccc(-c2ccccc2)cc1- InChIKey
VQUIWJXQTBMPAE-UHFFFAOYSA-N- Molecular formula
- C20H16O
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.12011513
Names & identifiers
- Preferred name
- Benzophenone, 2-methyl-4'-phenyl-
- IUPAC
- (2-methylphenyl)-(4-phenylphenyl)methanone
- English name
- Methanone, [1,1'-biphenyl]-4-yl(2-methylphenyl)-
- Molecular formula
- C20H16O
- Molecular weight
- 272.34
Names & synonyms
2-Methyl-4'-phenylbenzophenone85296-08-8BRN 3302902BENZOPHENONE, 2-METHYL-4'-PHENYL-Methanone, (1,1'-biphenyl)-4-yl(2-methylphenyl)-DTXSID302344974-07-00-01832 (Beilstein Handbook Reference)RefChem:328128DTXCID30156988BIPHENYL-4-YL-O-TOLYL-METHANONEMFCD00228473{[1,1'-BIPHENYL]-4-YL}(2-METHYLPHENYL)METHANONE
Show more names
[1,1'-Biphenyl]-4-yl(2-methylphenyl)methanone[1,1'-Biphenyl]-4-yl(2-methylphenyl)methanoneMethanone, [1,1'-biphenyl]-4-yl(2-methylphenyl)-
([1,1'-Biphenyl]-4-yl)(2-methylphenyl)methanone(2-methylphenyl)-(4-phenylphenyl)methanoneSCHEMBL6018419SCHEMBL30516312o-tolyl-(4-phenylphenyl)methanoneAKOS009338108DB-240351
Database identifiers
- CAS
85296-08-8- PubChem CID
- 55326
- DTXSID
DTXSID30234497- EC Number
- 688-846-2
- Nikkaji
- J1.826.876K
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 334
Physicochemical properties
- Melting point
- 103 · 103-104 °C(Solv: hexane (110-54-3))
- Boiling point
- 411.3 · 411.3±24.0 °C(Predicted)
- Density
- 1.093 · 1.093±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Suppliers
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Related reactions
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Compound notes
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