4-Methoxy-9H-xanthene
Basic information
- CAS
38731-90-7- Standard SMILES
COc1cccc2c1Oc1ccccc1C2- InChIKey
VUFNFAAEMMFBLD-UHFFFAOYSA-N- Molecular formula
- C14H12O2
- Average molar mass
- 212.24 g/mol
- Monoisotopic mass
- 212.08372962
Names & identifiers
- Preferred name
- 4-Methoxy-9H-xanthene
- IUPAC
- 4-methoxy-9H-xanthene
Names & synonyms
4-METHOXY-9H-XANTHENE38731-90-7DTXSID90502341RefChem:293919DTXCID804531514-Methoxy-xantheneSCHEMBL5758407VUFNFAAEMMFBLD-UHFFFAOYSA-N
Database identifiers
- CAS
38731-90-7- PubChem CID
- 12554339
- DTXSID
DTXSID90502341- Nikkaji
- J2.688.285K
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Related reactions
2 records
Compound notes
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