Basic information
- Standard SMILES
O=C(O)c1cccc2oc(C3CC3)nc12- InChIKey
PFMUWEPYMRKJDH-UHFFFAOYSA-N- Molecular formula
- C11H9NO3
- Average molar mass
- 203.19 g/mol
Names & identifiers
- Preferred name
- 2-Cyclopropylbenzoxazole-4-carboxylic acid
- IUPAC
- 2-cyclopropyl-1,3-benzoxazole-4-carboxylic acid
Names & synonyms
SCHEMBL4315476PFMUWEPYMRKJDH-UHFFFAOYSA-NAKOS0199189302-cyclopropylbenzoxazole-4-carboxylic acid
Database identifiers
- PubChem CID
- 68999940
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 277
Related reactions
5 records
Compound notes
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