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Basic information
- Standard SMILES
CCCCCCc1cc(-c2cc(CCCCCC)[nH]n2)n[nH]1- InChIKey
ORLXMIXBEJYGTM-UHFFFAOYSA-N- Molecular formula
- C18H30N4
- Average molar mass
- 302.5 g/mol
- Monoisotopic mass
- 302.24704697
Names & identifiers
- Preferred name
- 5-hexyl-3-(5-hexyl-1H-pyrazol-3-yl)-1H-pyrazole
- IUPAC
- 5-hexyl-3-(5-hexyl-1H-pyrazol-3-yl)-1H-pyrazole
Names & synonyms
NSC371851NSC-371851
Database identifiers
- PubChem CID
- 340770
Properties
Computed structural propertiesFilling in
- XLogP
- 5.8
- Topological polar surface area
- 57.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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