3-(hydroxymethyl)-3,4-dihydro-1H-2-benzopyran-1-one
Structure Info
- Chemspace ID
- CSSS00011054365 (In-Stock Screening Compounds)
- CAS
- 655245-61-7
- IUPAC Name
- 3-(hydroxymethyl)-3,4-dihydro-1H-2-benzopyran-1-one
- Mol formula
- C10H10O3
- Mol weight
- 178 Da
- Catalog Number(s)
- BBV-56360714, CSC011054365, FCH2556700, Y1502241, Z1898547501
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.19
- Heavy atoms count
- 13
- Rotatable bond count
- 1
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.3
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00011054365
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