1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-
TL;DR: 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- (CAS 4320-85-8) is a chemical compound with molecular formula C5H10N2 and molecular weight 98.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-1,4-dihydropyrazole
Also Known As: 5-dimethylpyrazoline, 5,5-Dimethyl-2-pyrazoline, 5,5-Dimethyl-4,5-dihydro-1H-pyrazole, 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-, 5,5-dimethyl-1,4-dihydropyrazole
| Molecular Formula | C5H10N2 |
|---|---|
| Molecular Weight | 98.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 24.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.0844 |
| Heavy Atoms | 7 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 4320-85-8 |
|---|---|
| SMILES | CC1(CC=NN1)C |
| InChIKey | FLYZAKYDSFYRRD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- (CAS 4320-85-8), with molecular formula C5H10N2 and molecular weight 98.08 g/mol. IUPAC: 5,5-dimethyl-1,4-dihydropyrazole.
Chemical Property Profile of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-
Property Insights of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-. With a topological polar surface area (TPSA) of 24.4 Ų, 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-?
The CAS number of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- is 4320-85-8.
What is the molecular formula of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-?
The molecular formula of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- is C5H10N2.
What is the molecular weight of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-?
The molecular weight of 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- is 98.08 g/mol.
Where can I buy 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-?
You can request a quote for 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrazole, 4,5-dihydro-5,5-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.