Basic information
- CAS
438543-74-9- Standard SMILES
Cc1ccc(Oc2ccccc2O)c(O)c1- InChIKey
MZIJGDJZBODVDZ-UHFFFAOYSA-N- Molecular formula
- C13H12O3
- Average molar mass
- 216.23 g/mol
- Monoisotopic mass
- 216.07864424
Names & identifiers
- Preferred name
- 2-(2-Hydroxyphenoxy)-5-methylphenol
- IUPAC
- 2-(2-hydroxyphenoxy)-5-methylphenol
Names & synonyms
2-(2-hydroxyphenoxy)-5-methylphenol438543-74-95-methyl-2-(2-hydroxyphenoxy)phenolphenol, 2-(2-hydroxyphenoxy)-5-methyl-Phenol, 2-(2-hydroxyphenoxy)-5-methyl- (9CI)BDBM3911SCHEMBL7546534DTXSID90349359PD 200828
Database identifiers
- CAS
438543-74-9- PubChem CID
- 644283
- DTXSID
DTXSID90349359- Nikkaji
- J2.106.665F
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 219
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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