3-Isoxazolecarboxylic acid, 5-methyl-, 2-phenethylhydrazide, hydrochloride
Basic information
- CAS
96732-05-7- Standard SMILES
Cc1cc(C(=O)N[NH2+]CCc2ccccc2)no1.[Cl-]- InChIKey
WGSJVYMWCVACNY-UHFFFAOYSA-N- Molecular formula
- C13H16ClN3O2
- Average molar mass
- 281.74 g/mol
- Monoisotopic mass
- 281.0931045
Names & identifiers
- Preferred name
- 3-Isoxazolecarboxylic acid, 5-methyl-, 2-phenethylhydrazide, hydrochloride
- IUPAC
- [(5-methyl-1,2-oxazole-3-carbonyl)amino]-(2-phenylethyl)azanium chloride
Names & synonyms
96732-05-73-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-, 2-PHENETHYLHYDRAZIDE, HYDROCHLORIDERefChem:10680951-Phenethyl-2-(5-methyl-3-isoxazolylcarbonyl)hydrazine hydrochloride5-Methyl-N'-phenethylisoxazole-3-carbohydrazidehydrochloride5-Methyl-3-isoxazolecarboxylic acid 2-phenethylhydrazide hydrochloride[(5-methyl-1,2-oxazole-3-carbonyl)amino]-phenethylazanium chloride[(5-methyl-1,2-oxazole-3-carbonyl)amino]-(2-phenylethyl)azanium;chlorideCID57128, LS-86646, 5-Methyl-3-isoxazolecarboxylic acid 2-phenethylhydrazide hydrochloride, 1-Phenethyl-2-(5-methyl-3-isoxazolylcarbonyl)hydrazine hydrochloride, 3-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-, 2-PHENETHYLHYDRAZIDE, HYDROCHLORIDE, 96732-05-7
Database identifiers
- CAS
96732-05-7- PubChem CID
- 57128
Properties
Computed structural properties
- Topological polar surface area
- 71.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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