3-Isoxazolecarboxylic acid, 5-methyl-, 2-(alpha-methylphenethyl)hydrazide
Basic information
- CAS
60789-89-1- Standard SMILES
Cc1cc(C(=O)NNC(C)Cc2ccccc2)no1- InChIKey
BYBUKOLWVLGTJF-UHFFFAOYSA-N- Molecular formula
- C14H17N3O2
- Average molar mass
- 259.3 g/mol
- Monoisotopic mass
- 259.13207679
Names & identifiers
- Preferred name
- 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(alpha-methylphenethyl)hydrazide
- IUPAC
- 5-methyl-N'-(1-phenylpropan-2-yl)-1,2-oxazole-3-carbohydrazide
- English name
- N'-(α-Methylphenethyl)-5-methyl-3-isoxazolecarbohydrazide
- Molecular formula
- C14H17N3O2
- Molecular weight
- 259.3
Names & synonyms
60789-89-13-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-, 2-(alpha-METHYLPHENETHYL)HYDRAZIDERefChem:1068093NSC169892MLS0031067285-methyl-N'-(1-phenylpropan-2-yl)-1,2-oxazole-3-carbohydrazideRo 5-12261-(alpha-Methylphenethyl)-2-(5-methyl-3-isoxazolylcarbonyl)hydrazine5-Methyl-3-isoxazolecarboxylic acid 2-(alpha-methylphenethyl)hydrazideHydrazine, 2-(5-methyl-3-isoxazolylcarbonyl)-1-(alpha-methylphenethyl)-3-Isoxazolecarboxylic acid, 5-methyl-, 2-(1-methyl-2-phenylethyl)hydrazideDTXSID70976263
Show more names
Ro-5-1226N'-(α-Methylphenethyl)-5-methyl-3-isoxazolecarbohydrazide
NSC-169892SMR001821619DB-3087435-Methyl-N'-(1-methyl-2-phenylethyl)isoxazole-3-carbohydrazideN'-(alpha-methylphenethyl)-5-methyl-3-isoxazolecarbohydrazide5-methyl-N'-(1-methyl-2-phenyl-ethyl)isoxazole-3-carbohydrazide
Database identifiers
- CAS
60789-89-1- PubChem CID
- 43479
- DTXSID
DTXSID70976263- Nikkaji
- J77.803F
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- Boiling point
- 402.56 °C · 402.56°C (rough estimate)
- Density
- 1.1182 · 1.1182 (rough estimate)
- refractive index
- 1.57 · 1.5700 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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