Basic information
- CAS
27667-40-9- Standard SMILES
Oc1ccc(C=Cc2ccc(O)c3cccc(O)c23)cc1- InChIKey
OSPPFOOFRJYKNT-UHFFFAOYSA-N- Molecular formula
- C18H14O3
- Average molar mass
- 278.3 g/mol
- Monoisotopic mass
- 278.0942943
Names & identifiers
- Preferred name
- Agn-PC-0jtjxo
- IUPAC
- 4-[2-(4-hydroxyphenyl)ethenyl]naphthalene-1,5-diol
- English name
- 4-(p-Hydroxystyryl)-1,5-naphthalenediol
- Molecular formula
- C18H14O3
- Molecular weight
- 278.3
Names & synonyms
AGN-PC-0JTJXODTXSID1034470027667-40-94-[2-(4-Hydroxyphenyl)ethen-1-yl]naphthalene-1,5-diol4-(p-Hydroxystyryl)-1,5-naphthalenediol4-[2-(4-hydroxyphenyl)ethenyl]naphthalene-1,5-diol1,5-Naphthalenediol, 4-[2-(4-hydroxyphenyl)ethenyl]-
Database identifiers
- CAS
27667-40-9- PubChem CID
- 598917
- DTXSID
DTXSID10344700
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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