Benzene, 1-(1-methyl-1-phenylethyl)-4-(phenylmethoxy)-
Basic information
- CAS
68443-34-5- Standard SMILES
CC(C)(c1ccccc1)c1ccc(OCc2ccccc2)cc1- InChIKey
IZLBYQPKAHATAF-UHFFFAOYSA-N- Molecular formula
- C22H22O
- Average molar mass
- 302.4 g/mol
- Monoisotopic mass
- 302.16706532
Names & identifiers
- Preferred name
- Benzene, 1-(1-methyl-1-phenylethyl)-4-(phenylmethoxy)-
- IUPAC
- 1-phenylmethoxy-4-(2-phenylpropan-2-yl)benzene
- English name
- 1-benzyloxy-4-(1-methyl-1-phenylethyl)benzene
- Molecular formula
- C22H22O
- Molecular weight
- 302.41
Names & synonyms
Benzyl p-cumylphenyl ether68443-34-5EINECS 270-511-3Benzene, 1-(1-methyl-1-phenylethyl)-4-(phenylmethoxy)-DTXSID00887393RefChem:562353DTXCID5010266881-Benzyloxy-4-(1-methyl-1-phenylethyl)benzene1-(1-Methyl-1-phenylethyl)-4-(phenylmethoxy)benzeneSCHEMBL1681364SCHEMBL8748176SCHEMBL9787003
Show more names
1-(BENZYLOXY)-4-(2-PHENYLPROPAN-2-YL)BENZENEIZLBYQPKAHATAF-UHFFFAOYSA-NNS00062560
Database identifiers
- CAS
68443-34-5- PubChem CID
- 110267
- DTXSID
DTXSID00887393- EC Number
- 270-511-3
- Nikkaji
- J310.540G
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 328
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 430.2 · 430.2±24.0 °C(Predicted)
- Density
- 1.052 · 1.052±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- Benzyl p-cumylphenyl ether (68443-34-5)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1-(1-methyl-1-phenylethyl)-4-(phenylmethoxy)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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