Basic information
- CAS
1638-12-6- Standard SMILES
c1ccc(Oc2ccc(Oc3cccc(Oc4ccc(Oc5ccccc5)cc4)c3)cc2)cc1- InChIKey
KYSKNYFGWVBAOD-UHFFFAOYSA-N- Molecular formula
- C30H22O4
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.15180918
Names & identifiers
- Preferred name
- Benzene, 1,3-bis(4-phenoxyphenoxy)-
- IUPAC
- 1,3-bis(4-phenoxyphenoxy)benzene
- English name
- 1,3-bis(4-phenoxyphenoxy)benzene
- Molecular formula
- C30H22O4
- Molecular weight
- 446.49
Names & synonyms
1,3-Bis(4-phenoxyphenoxy)benzeneBenzene, 1,3-bis(4-phenoxyphenoxy)-EINECS 216-669-9DTXSID4061838RefChem:117293DTXCID4035257216-669-91638-12-6SCHEMBL3888963KYSKNYFGWVBAOD-UHFFFAOYSA-NDB-273847NS00021726
Show more names
1,1'-[1,3-Phenylenebis(oxy)]bis(4-phenoxybenzene)
Database identifiers
- CAS
1638-12-6- PubChem CID
- 74223
- DTXSID
DTXSID4061838- EC Number
- 216-669-9
- Nikkaji
- J195.270F
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 506
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 88 · 88-89 °C
- Boiling point
- 287 · 287-293 °C(Press: 0.3 Torr)
- Density
- 1.2 · 1.200±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 1 · Benzene, 1,3-bis(4-phenoxyphenoxy)- (1638-12-6)
- 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.
Hazard information
Regulatory InformationChemical: Benzene, 1,3-bis(4-phenoxyphenoxy)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,3-bis(4-phenoxyphenoxy)-: ACTIVE
Upstream & downstream products
Upstream raw materials
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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