Basic information
- CAS
6563-60-6- Standard SMILES
COc1cccc2oc3ccccc3c(=O)c12- InChIKey
IVWOUZKNCGFRBC-UHFFFAOYSA-N- Molecular formula
- C14H10O3
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.06299418
Names & identifiers
- Preferred name
- 9H-Xanthen-9-one, 1-methoxy-
- IUPAC
- 1-methoxyxanthen-9-one
- English name
- 1-Methoxyxanthen-9-one
- Molecular formula
- C14H10O3
- Molecular weight
- 226.23
Names & synonyms
1-methoxyxanthen-9-one6563-60-69H-Xanthen-9-one, 1-methoxy-1-Methoxy-9H-xanthen-9-oneCHEMBL364619Xanthen-9-one, 1-methoxy-methoxyxanthone1-Methoxyxanthone1-Methoxy-xanthen-9-oneSCHEMBL6407461-Methoxy-9H-xanthen-9-one #DTXSID80215877
Show more names
IVWOUZKNCGFRBC-UHFFFAOYSA-NBDBM50155412
Database identifiers
- CAS
6563-60-6- PubChem CID
- 81046
- DTXSID
DTXSID80215877- ChEMBL
CHEMBL364619- Nikkaji
- J130.930G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 302
Chemistry & industry
Suppliers6 total
TYGER[email protected]
THREEB-MED[email protected]
上海洛茵氟化工有限公司[email protected]
先进技术工业有限公司[email protected]
FULCRUM—
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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