Basic information
- Standard SMILES
CC(C)(C)c1ccccc1-c1ccc(OP(=O)(O)O)cc1- InChIKey
GIIBUWXACJTJDE-UHFFFAOYSA-N- Molecular formula
- C16H19O4P
- Average molar mass
- 306.29 g/mol
- Monoisotopic mass
- 306.10209608
Names & identifiers
- Preferred name
- ({2'aTertabutyla[1,1'abiphenyl]a4a yl}oxy)phosphonic acid
- IUPAC
- [4-(2-tert-butylphenyl)phenyl] dihydrogen phosphate
Names & synonyms
SCHEMBL29093881DTXSID801352373({2'aTertabutyla[1,1'abiphenyl]a4a yl}oxy)phosphonic acid
Database identifiers
- PubChem CID
- 175479090
- DTXSID
DTXSID801352373
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 376
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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