Basic information
- CAS
87149-79-9- Standard SMILES
COC(Cc1nocc1N)OC- InChIKey
YKCKIEIEDKOPNO-UHFFFAOYSA-N- Molecular formula
- C7H12N2O3
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.08479225
Names & identifiers
- Preferred name
- 3-(2,2-Dimethoxyethyl)-1,2-oxazol-4-amine
- IUPAC
- 3-(2,2-dimethoxyethyl)-1,2-oxazol-4-amine
Names & synonyms
87149-79-93-(2,2-dimethoxyethyl)isoxazol-4-amine3-(2,2-Dimethoxyethyl)-1,2-oxazol-4-amineDTXSID70519775AKOS030549295F2147-8655
Database identifiers
- CAS
87149-79-9- PubChem CID
- 13123749
- DTXSID
DTXSID70519775
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 130
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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