Basic information
- CAS
466-37-5- Standard SMILES
O=C(c1ccccc1)C(c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
CFBBKHROQRFCNZ-UHFFFAOYSA-N- Molecular formula
- C26H20O
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.15141526
Names & identifiers
- Preferred name
- 1,2,2,2-Tetraphenylethanone
- IUPAC
- 1,2,2,2-tetraphenylethanone
- English name
- 2,2,2-Triphenylacetophenone
- Molecular formula
- C26H20O
- Molecular weight
- 348.44
Names & synonyms
2,2,2-Triphenylacetophenone466-37-51,2,2,2-TetraphenylethanoneAI3-18040DTXSID50196881RefChem:1051861DTXCID90119372207-375-1BenzopinacoloneTetraphenylethanoneEthanone, tetraphenyl-Phenyl trityl ketone
Show more names
2,2,2- Triphenα-benzopinacolinα-benzpinacoloneB-BenzopinacolineB-BENZOPINACOLONEBenzopinacolone,97%
MFCD00004762Acetophenone, 2,2,2-triphenyl-NSC-1941,2,2,2-tetraphenylethan-1-oneNSC-2820beta-Benzopinacolonetetraphenylethan-1-oneNSC194
Database identifiers
- CAS
466-37-5- PubChem CID
- 68049
- DTXSID
DTXSID50196881- UNII
- 7E2R2AL4JY
- EC Number
- 207-375-1
- Nikkaji
- J63I
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 411
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 182 · 182-184 °C (lit.)
- Boiling point
- 442.8 °C · 442.8°C (rough estimate)
- Density
- 1.0447 · 1.0447 (rough estimate)
- refractive index
- 1.638 · 1.6380 (estimate)
- storage temp.
- Storage temperature: no restrictions.
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- BRN
- 2058376 · 2058376
- InChI
- 1S/C26H20O/c27-25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H
- InChIKey
- CFBBKHROQRFCNZ-UHFFFAOYSA-N
- SMILES
- O=C(c1ccccc1)C(c2ccccc2)(c3ccccc3)c4ccccc4
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 2914.39.9000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
Uses2,2,2-Triphenylacetophenone is an endocrine disrupter that is medicated through estrogen receptors.
General DescriptionAsymmetric reduction of 2,2,2-triphenylacetophenone using with potassium 9-O-(1,2: 5, 6-di-O-isopropylidene-α-D-glucofuranosyl)-9-boratabicyclo [3.3.1] nonane (chiral reducing agent) has been reported. Dehydrative cyclization of 2,2,2-triphenylacetophenone has been reported.
Upstream & downstream products
Upstream raw materials
Suppliers63 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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