Basic information
- CAS
17512-08-2- Standard SMILES
C=C=C(C)Cc1c(C)c(C)nn1C- InChIKey
FXOTWDYPDWRMSA-UHFFFAOYSA-N- Molecular formula
- C11H16N2
- Average molar mass
- 176.26 g/mol
- Monoisotopic mass
- 176.13134852
Names & identifiers
- Preferred name
- Pyrazole, 5-(2-methyl-2,3-butadienyl)-1,3,4-trimethyl-
- IUPAC
- 1,3,4-trimethyl-5-(2-methylbuta-2,3-dienyl)pyrazole
- English name
- Pyrazole, 5-(2-methyl-2,3-butadienyl)-1,3,4-trimethyl-,
- Molecular formula
- C11H16N2
- Molecular weight
- 0
Names & synonyms
17512-08-2Pyrazole, 5-(2-methyl-2,3-butadienyl)-1,3,4-trimethyl-,1,3,4-trimethyl-5-(2-methylbuta-2,3-dienyl)pyrazolePyrazole, 5-(2-methyl-2,3-butadienyl)-1,3,4-trimethyl-Pyrazole, 1,3,4-trimethyl-5-(2-methyl-2,3-butadienyl)-1,3,4-trimethyl-5-(2-methyl-buta-2,3-dienyl)-1H-pyrazole
Database identifiers
- CAS
17512-08-2- PubChem CID
- 140239
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 228
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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