6-Benzoxazoleacetic acid, 2-phenyl-
Basic information
- CAS
62143-69-5- Standard SMILES
O=C(O)Cc1ccc2nc(-c3ccccc3)oc2c1- InChIKey
WZZFSFRRNAKILX-UHFFFAOYSA-N- Molecular formula
- C15H11NO3
- Average molar mass
- 253.25 g/mol
- Monoisotopic mass
- 253.07389321
Names & identifiers
- Preferred name
- 6-Benzoxazoleacetic acid, 2-phenyl-
- IUPAC
- 2-(2-phenyl-1,3-benzoxazol-6-yl)acetic acid
- English name
- 2-(2-phenylbenzooxazol-6-yl)acetic acid
- Molecular formula
- C15H11NO3
- Molecular weight
- 253.25
Names & synonyms
2-Phenyl-6-benzoxazoleacetic acid62143-69-56-BENZOXAZOLEACETIC ACID, 2-PHENYL-BRN 1079613DTXSID70211202RefChem:307249DTXCID301336932-(2-PHENYLBENZOOXAZOL-6-YL)ACETIC ACIDSCHEMBL4417082CHEMBL3246576WZZFSFRRNAKILX-UHFFFAOYSA-N2-phenyl-6-benzoxazolylacetic acid
Show more names
DB-363951(2-PHENYL-1,3-BENZOXAZOL-6-YL)ACETIC ACID
Database identifiers
- CAS
62143-69-5- PubChem CID
- 43931
- DTXSID
DTXSID70211202- ChEMBL
CHEMBL3246576- Nikkaji
- J67.884H
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 327
Related reactions
4 records
Compound notes
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