Basic information
- CAS
5330-57-4- Standard SMILES
CC(C)(C)c1cc(O)c(C(=O)O)cc1O- InChIKey
HXRNAHTXZNOPRD-UHFFFAOYSA-N- Molecular formula
- C11H14O4
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.08920892
Names & identifiers
- Preferred name
- 4-Tert-butyl-2,5-dihydroxybenzoic acid
- IUPAC
- 4-tert-butyl-2,5-dihydroxybenzoic acid
Names & synonyms
4-TERT-BUTYL-2,5-DIHYDROXYBENZOIC ACID5330-57-4NSC2494SCHEMBL11760104DTXSID40277476
Database identifiers
- CAS
5330-57-4- PubChem CID
- 220160
- DTXSID
DTXSID40277476
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 243
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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