(1-Isobutyl-1H-pyrazol-4-yl)methanamine hydrochloride
Basic information
- CAS
1431963-82-4- Standard SMILES
CC(C)Cn1cc(CN)cn1.Cl- InChIKey
RZXNXQVMGBMVKM-UHFFFAOYSA-N- Molecular formula
- C8H16ClN3
- Average molar mass
- 189.68 g/mol
- Monoisotopic mass
- 189.1032752
Names & identifiers
- Preferred name
- (1-Isobutyl-1H-pyrazol-4-yl)methanamine hydrochloride
- IUPAC
- [1-(2-methylpropyl)pyrazol-4-yl]methanamine;hydrochloride
Names & synonyms
1431963-82-4(1-Isobutyl-1H-pyrazol-4-yl)methanamine hydrochloride(1-Isobutyl-1H-pyrazol-4-yl)methylamine hydrochloride[1-(2-methylpropyl)pyrazol-4-yl]methanamine;hydrochlorideMFCD25371117starbld0031205AKOS024392472(1-isobutylpyrazol-4-yl)methanamine;hydrochloride
Database identifiers
- CAS
1431963-82-4- PubChem CID
- 75530183
Properties
Computed structural properties
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 114
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Compound notes
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