3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-
TL;DR: 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- (CAS 3201-25-0) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4,5-tetramethylpyrazol-3-one
Also Known As: 2,4,4,5-tetramethylpyrazol-3-one, 2-Pyrazolin-5-one, 1,3,4,4-tetramethyl-, 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-, 1,3,4,4-Tetramethyl-5-pyrazolinone, 1,3,4,4,-Tetramethylpyrazolin-5-on
| Molecular Formula | C7H12N2O |
|---|---|
| Molecular Weight | 140.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.09496 |
| Heavy Atoms | 10 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 3201-25-0 |
|---|---|
| SMILES | CC1=NN(C(=O)C1(C)C)C |
| InChIKey | BXPVASXSXJSJCE-UHFFFAOYSA-N |
Product Overview
3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- (CAS 3201-25-0), with molecular formula C7H12N2O and molecular weight 140.09 g/mol. IUPAC: 2,4,4,5-tetramethylpyrazol-3-one.
Chemical Property Profile of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-
Property Insights of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-. With a topological polar surface area (TPSA) of 32.7 Ų, 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- has 0 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 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-?
The CAS number of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- is 3201-25-0.
What is the molecular formula of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-?
The molecular formula of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- is C7H12N2O.
What is the molecular weight of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-?
The molecular weight of 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- is 140.09 g/mol.
Where can I buy 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-?
You can request a quote for 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Pyrazol-3-one, 2,4-dihydro-2,4,4,5-tetramethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.