Basic information
- CAS
25640-70-4- Standard SMILES
CC(c1ccccc1)c1ccc(O)c(C(C)c2ccccc2)c1- InChIKey
RCFAHSGZAAFQJH-UHFFFAOYSA-N- Molecular formula
- C22H22O
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.16706532
Names & identifiers
- Preferred name
- 2,4-Bis(1-Phenylethyl)Phenol
- IUPAC
- 2,4-bis(1-phenylethyl)phenol
- English name
- 2,4-bis(1-phenylethyl)phenol
- Molecular formula
- C22H22O
- Molecular weight
- 302.41
Names & synonyms
2,4-Bis(1-phenylethyl)phenolPhenol, 2,4-bis(1-phenylethyl)-UNII-8Q3R0CBD0S8Q3R0CBD0SEINECS 220-460-8AI3-08264J166.879JDTXSID508630212,4-DI(1-PHENYLETHYL)PHENOL2,4-BIS(1-METHYLBENZYL)PHENOLPhenol, 2,4-bis(.alpha.-methylbenzyl)-2,4-BIS(.ALPHA.-METHYLBENZYL)PHENOL
Show more names
2,4-Di(α-methylbenzyl)phenol
RefChem:82212DTXCID108117052,4-BIS(ALPHA-METHYLBENZYL)PHENOLPHENOL, 2,4-BIS(ALPHA-METHYLBENZYL)-220-460-8RCFAHSGZAAFQJH-UHFFFAOYSA-N2769-94-02,4-bis-(1-Phenylethyl)phenol
Database identifiers
- CAS
25640-70-4、2769-94-0- PubChem CID
- 102877
- DTXSID
DTXSID50863021- ChEMBL
CHEMBL252313- UNII
- 8Q3R0CBD0S
- EC Number
- 220-460-8、247-154-7
- Nikkaji
- J166.879J
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 340
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physical DescriptionLiquid
Physicochemical properties
- Boiling point
- 186 · 186-210 °C(Press: 20-21 Torr)
- Density
- 1.083 g/cm3 · 1.0830 g/cm3
- pka
- 10.42 · 10.42±0.10(Predicted)
- FDA UNII
- 8 Q3R0CBD0S · 8Q3R0CBD0S
- EPA Substance Registry System
- 2 · Phenol, 2,4-bis(1-phenylethyl)- (2769-94-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (105 of 105) of all reports.
Not Classified
Aggregated GHS information provided per 105 reports by companies from 1 notifications to the ECHA C&L Inventory.
This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.
Warning
H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]
Hazard information
Regulatory Information
Phenol, bis(1-phenylethyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Phenol, bis(1-phenylethyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Hazard Classes and Categories
Skin Irrit. 2 (66.7%)
Not Classified
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H315-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 250,000 - <550,000 lb
Industry UsesIntermediate
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Phenol, 2,4-bis(1-phenylethyl)-: ACTIVE
Phenol, bis(1-phenylethyl)-: ACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
3 records
Compound notes
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