Spiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one, 3'-phenyl-
Basic information
- CAS
21733-37-9- Standard SMILES
O=C1c2ccccc2OCC12OC2c1ccccc1- InChIKey
HVDVEAXOLCCDGZ-UHFFFAOYSA-N- Molecular formula
- C16H12O3
- Average molar mass
- 252.26 g/mol
- Monoisotopic mass
- 252.07864424
Names & identifiers
- Preferred name
- Spiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one, 3'-phenyl-
- IUPAC
- 3'-phenylspiro[2H-chromene-3,2'-oxirane]-4-one
Names & synonyms
3'-Phenylspiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one21733-37-9Spiro(2H-1-benzopyran-3(4H),2'-oxiran)-4-one, 3'-phenyl-RefChem:380844DTXSID709443463'-Phenyl-2H,4H-spiro[[1]benzopyran-3,2'-oxiran]-4-one3'-Phenyl-2H,4H-spiro[1-benzopyran-3,2'-oxiran]-4-one
Database identifiers
- CAS
21733-37-9- PubChem CID
- 210834
- DTXSID
DTXSID70944346
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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