Basic information
- CAS
57114-73-5- Standard SMILES
C=C1Nc2ccccc2O1- InChIKey
XWPHROCGRQOCJK-UHFFFAOYSA-N- Molecular formula
- C8H7NO
- Average molar mass
- 133.15 g/mol
- Monoisotopic mass
- 133.05276385
Names & identifiers
- Preferred name
- 2-Methylidene-2,3-dihydro-1,3-benzoxazole
- IUPAC
- 2-methylidene-3H-1,3-benzoxazole
Names & synonyms
57114-73-52-Methylidene-2,3-dihydro-1,3-benzoxazoleSCHEMBL764769SCHEMBL7471927DTXSID30601948
Database identifiers
- CAS
57114-73-5- PubChem CID
- 20042869
- DTXSID
DTXSID30601948
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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