4,6-Dimethyl-2,4,6-triphenyl-1-heptene
Basic information
- CAS
62604-62-0- Standard SMILES
C=C(CC(C)(CC(C)(C)c1ccccc1)c1ccccc1)c1ccccc1- InChIKey
OAMAKKTXAPRVDG-UHFFFAOYSA-N- Molecular formula
- C27H30
- Average molar mass
- 354.5 g/mol
- Monoisotopic mass
- 354.23475096
Names & identifiers
- Preferred name
- 4,6-Dimethyl-2,4,6-triphenyl-1-heptene
- IUPAC
- (2,4-dimethyl-4,6-diphenylhept-6-en-2-yl)benzene
- English name
- 1,1',1''-(1,1,3-trimethyl-5-methylenepentane-1,3,5-triyl)tribenzene
- Molecular formula
- C27H30
- Molecular weight
- 354.53
Names & synonyms
4,6-Dimethyl-2,4,6-triphenyl-1-heptene62604-62-0EINECS 263-624-4RE7UDN80O2Benzene, 1,1',1''-(1,1,3-trimethyl-5-methylene-1,3,5-pentanetriyl)tris-DTXSID408864861,1',1''-(1,1,3-Trimethyl-5-methylenepentane-1,3,5-triyl)tribenzeneBENZENE, 1,1',1''-(1,1,3-TRIMETHYL-5-METHYLENE-1,3,5-PENTANETRIYL)TRIS-; 4,6-DIMETHYL-2,4,6-TRIPHENYL-1-HEPTENERefChem:508118DTXCID301025810UNII-RE7UDN80O2SCHEMBL7172775
Show more names
(4,6-dimethyl-2,6-diphenylhept-1-en-4-yl)benzene
OAMAKKTXAPRVDG-UHFFFAOYSA-NNS00056208Q272880691,1',1''-(4,6-Dimethylhept-1-ene-2,4,6-triyl)tribenzene
Database identifiers
- CAS
62604-62-0- PubChem CID
- 112502
- DTXSID
DTXSID40886486- UNII
- RE7UDN80O2
- EC Number
- 263-624-4
- Nikkaji
- J307.080H
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 454
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 474.2 · 474.2±40.0 °C(Predicted)
- Density
- 0.991 · 0.991±0.06 g/cm3(Predicted)
- FDA UNII
- 7 UDN80O2 · RE7UDN80O2
- EPA Substance Registry System
- 4 · 4,6-Dimethyl-2,4,6-triphenyl-1-heptene (62604-62-0)
- 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.
GHS classification
GHS ClassificationNot Classified
Hazard information
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,1',1''-(1,1,3-trimethyl-5-methylene-1,3,5-pentanetriyl)tris-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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