Basic information
- CAS
62143-74-2- Standard SMILES
CC(C[NH3+])c1ccc2nc(-c3ccccc3)oc2c1.O=C([O-])CCC(=O)O- InChIKey
KCKIUQPEYZGQBI-UHFFFAOYSA-N- Molecular formula
- C20H22N2O5
- Average molar mass
- 370.4 g/mol
- Monoisotopic mass
- 370.15287181
Names & identifiers
- Preferred name
- 6-Benzoxazoleethylamine, beta-methyl-2-phenyl-, hemisuccinate
- IUPAC
- 4-hydroxy-4-oxobutanoate;2-(2-phenyl-1,3-benzoxazol-6-yl)propylazanium
Names & synonyms
6-BENZOXAZOLEETHYLAMINE, beta-METHYL-2-PHENYL-, HEMISUCCINATE62143-74-2RefChem:1073822beta-Methyl-2-phenyl-6-benzoxazoleethylamine hemisuccinate
Database identifiers
- CAS
62143-74-2- PubChem CID
- 43934
Properties
Computed structural properties
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 392
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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