Basic information
- CAS
943-62-4- Standard SMILES
Cc1cc(C[NH+]2CCCCC2)no1.[Cl-]- InChIKey
GGIPSMNIEMSXNN-UHFFFAOYSA-N- Molecular formula
- C10H17ClN2O
- Average molar mass
- 216.71 g/mol
- Monoisotopic mass
- 216.1029409
Names & identifiers
- Preferred name
- Isoxazole, 5-methyl-3-(piperidinomethyl)-, hydrochloride
- IUPAC
- 5-methyl-3-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chloride
Names & synonyms
3-(Piperidinomethyl)-5-methylisoxazole hydrochloride943-62-4ISOXAZOLE, 5-METHYL-3-(PIPERIDINOMETHYL)-, HYDROCHLORIDERefChem:3502575-methyl-3-(piperidin-1-ium-1-ylmethyl)-1,2-oxazole chlorideCID13673, LS-86692, 3-(Piperidinomethyl)-5-methylisoxazole hydrochloride, ISOXAZOLE, 5-METHYL-3-(PIPERIDINOMETHYL)-, HYDROCHLORIDE, 943-62-4
Database identifiers
- CAS
943-62-4- PubChem CID
- 13673
Properties
Computed structural properties
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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