Basic information
- CAS
107317-30-6- Standard SMILES
CCC(O)(c1ccccc1)c1cccc(C(F)(F)F)c1- InChIKey
DVASNQYQOZHAJN-UHFFFAOYSA-N- Molecular formula
- C16H15F3O
- Average molar mass
- 280.28 g/mol
- Monoisotopic mass
- 280.10749958
Overview
Flumecinol is a diarylmethane.
Names & identifiers
- Preferred name
- alpha-Ethyl-alpha-phenyl-3-(trifluoromethyl)benzenemethanol
- IUPAC
- 1-phenyl-1-[3-(trifluoromethyl)phenyl]propan-1-ol
- English name
- flumecinol
- Molecular formula
- C16H15F3O
- Molecular weight
- 280.288
Names & synonyms
FLUMECINOL56430-99-0ZixorynFlumecinolumJB0YA8LDOWm-trifluoromethyl-alpha-ethylbenzhydrolBenzenemethanol, alpha-ethyl-alpha-phenyl-3-(trifluoromethyl)-1-(3-TRIFLUOROMETHYLPHENYL)-1-PHENYLPROPAN-1-OLflumacinolflumatsynolZiksorinalpha-Ethyl-alpha-phenyl-3-(trifluoromethyl)benzenemethanol
Show more names
3-(Trifluoromethyl)-α-ethylbenzhydrolα-Ethyl-α-phenyl-3-(trifluoromethyl)benzenemethanolα-Ethyl-α-phenyl-3-(trifluoromethyl)benzenemethanolBenzenemethanol, α-ethyl-α-phenyl-3-(trifluoromethyl)-
3-(trifluoromethyl)-alpha-ethylbenzhydrolRefChem:9155151-(3-trifluoromethylphenyl)-1-phenylpropanol260-176-1ZyxorinRGH-33321-phenyl-1-[3-(trifluoromethyl)phenyl]propan-1-olFlumecinol [INN]
Database identifiers
- CAS
107317-30-6、107317-31-7、56430-99-0- PubChem CID
- 41870
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Boiling point
- 0.03 · bp0.03 106-108°
- FDA UNII
- 0 YA8LDOW · JB0YA8LDOW
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Toxicity
- 50 orally · LD50 orally in adult rats: 2235 mg/kg (Ledniczky)
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
- Toxicity
- LD50 orally in adult rats: 2235 mg/kg (Ledniczky)
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
上海陶术生物科技股份有限公司13564774135 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
Additional notes
DefinitionChEBI: Flumecinol is a diarylmethane.
Related reactions
3 records
Compound notes
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