1-(5-Hydroxynaphtho[1,2-b]furan-3-yl)ethanone
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Basic information
- CAS
352553-09-4- Standard SMILES
CC(=O)c1coc2c1cc(O)c1ccccc12- InChIKey
WYMLGCDOZHERKB-UHFFFAOYSA-N- Molecular formula
- C14H10O3
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.06299418
Names & identifiers
- Preferred name
- 1-(5-Hydroxynaphtho[1,2-b]furan-3-yl)ethanone
- IUPAC
- 1-(5-hydroxybenzo[g][1]benzofuran-3-yl)ethanone
- English name
- 1-(5-HYDROXY-NAPHTHO[1,2-B]FURAN-3-YL)-ETHANONE
- Molecular formula
- C14H10O3
- Molecular weight
- 226.23
Names & synonyms
1-(5-hydroxynaphtho[1,2-b]furan-3-yl)ethanone352553-09-41-(5-hydroxybenzo[g][1]benzofuran-3-yl)ethanoneMFCD00552067CHEMBL13756991-{5-HYDROXYNAPHTHO[1,2-B]FURAN-3-YL}ETHANONEMLS000530193HMS2380G07CBDivE_006328DTXSID20366039BDBM50311455STK832662
Show more names
CHEMBRDG-BB 51690401-(5-HYDROXY-NAPHTHO[1,2-B]FURAN-3-YL)-ETHANONEEthanone, 1-(5-hydroxynaphtho[1,2-b]furan-3-yl)-1-(5-hydroxynaphtho[1,2-b]furan-3-yl)ethanone(SALTDATA: FREE)
AKOS005623094BS-36729DA-17050SMR0001351701-(5-hydroxybenzo[g]benzofuran-3-yl)ethanoneAB00074808-01AH-262/33701031F313887
Database identifiers
- CAS
352553-09-4- PubChem CID
- 2054569
- DTXSID
DTXSID20366039- ChEMBL
CHEMBL1375699
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 315
Physicochemical properties
- Boiling point
- 431.4 · 431.4±25.0 °C(Predicted)
- Density
- 1.327 · 1.327±0.06 g/cm3(Predicted)
- pka
- 8.05 · 8.05±0.30(Predicted)
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P261-P312-P304+P340-P305+P351+P338-P301+P330
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P261-P312-P304+P340-P305+P351+P338-P301+P330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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