Basic information
- CAS
63469-15-8- Standard SMILES
OC(CCC(O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
XRTGYBHBFOYLOB-UHFFFAOYSA-N- Molecular formula
- C28H26O2
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.19328007
Names & identifiers
- Preferred name
- 1,4-Butanediol, 1,1,4,4-tetraphenyl-
- IUPAC
- 1,1,4,4-tetraphenylbutane-1,4-diol
- English name
- Ethylenebis(diphenylmethanol)
- Molecular formula
- C28H26O2
- Molecular weight
- 394.5
Names & synonyms
63469-15-81,1,4,4-Tetraphenyl-1,4-butanediol1,4-BUTANEDIOL, 1,1,4,4-TETRAPHENYL-BRN 2177503DTXSID50699103-06-00-05933 (Beilstein Handbook Reference)NSC 84255RefChem:73160DTXCID4043933Ethylenebis(diphenylmethanol)1,1,4,4-tetraphenylbutane-1,4-diol1,1,4,4-TETRAPHENYL-1,4-BUTANE DIOL
Show more names
NSC84255WLN: QXR&R&2XQR&RSCHEMBL560935XRTGYBHBFOYLOB-UHFFFAOYSA-N1,4,4-Tetraphenyl-1,4-butanediolNSC-84255DB-319599
Database identifiers
- CAS
63469-15-8- PubChem CID
- 44541
- DTXSID
DTXSID5069910- Nikkaji
- J64.647D
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 409
Physicochemical properties
- Melting point
- 204 °C · 204 °C(Solv: acetic acid (64-19-7))
- Boiling point
- 478.7 °C · 478.7°C (rough estimate)
- Density
- 1.0383 · 1.0383 (rough estimate)
- refractive index
- 1.4875 · 1.4875 (estimate)
- pka
- 13.19 · 13.19±0.29(Predicted)
- EPA Substance Registry System
- 1 · 1,4-Butanediol, 1,1,4,4-tetraphenyl- (63469-15-8)
- 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 Information1,4-Butanediol, 1,1,4,4-tetraphenyl-: INACTIVE
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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