Basic information
- CAS
47157-01-7- Standard SMILES
Oc1c(Cc2ccccc2)cccc1Cc1ccccc1- InChIKey
DUCSXVAAPCQAEP-UHFFFAOYSA-N- Molecular formula
- C20H18O
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.13576519
Names & identifiers
- Preferred name
- 2,6-Dibenzylphenol
- IUPAC
- 2,6-dibenzylphenol
- English name
- 2,6-Dibenzylphenol
- Molecular formula
- C20H18O
- Molecular weight
- 274.36
Names & synonyms
2,6-Dibenzylphenol47157-01-72,6-Dibenzyl-phenolPhenol,2,6-bis(phenylmethyl)-MFCD02683215CHEMBL3316292,6-bisbenzylphenolNSC89783SCHEMBL4966037SCHEMBL10904907DTXSID90293469BDBM50012698
Show more names
2,6-DibenylphenolTIMTEC-BB SBB0085622,6-Bis(phenylmethyl)phenolPhenol, 2,6-bis(phenylmethyl)-2,6-DIBENZYLPHENOL ---CRYSTALLINE---
NSC-89783SBB008562AKOS015839255DB-080856ST50826063F81293F342217Q21569925
Database identifiers
- CAS
47157-01-7- PubChem CID
- 259641
- DTXSID
DTXSID90293469- ChEMBL
CHEMBL331629- Nikkaji
- J289.043G
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 260
Physicochemical properties
- Melting point
- 30 °C · 30 °C
- Boiling point
- 237.5 · 237.5-238 °C(Press: 10 Torr)
- Density
- 1.0805 g/cm3 · 1.0805 g/cm3
- pka
- 10.55 · 10.55±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers6 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海敏寒医药科技有限公司17612188245 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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