3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)
TL;DR: 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) (CAS 284488-23-9) is a chemical compound with molecular formula C7H10N2O and molecular weight 138.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-4-prop-2-enyl-1,4-dihydropyrazol-5-one
Also Known As: 4-allyl-3-methyl-4,5-dihydro-1H-pyrazol-5-one, 3-methyl-4-prop-2-enyl-1,4-dihydropyrazol-5-one, 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)- (9CI), 3h-pyrazol-3-one,2,4-dihydro-5-methyl-4-(2-propenyl)-, 5-methyl-4-(prop-2-en-1-yl)-2,4-dihydropyrazol-3-one
| Molecular Formula | C7H10N2O |
|---|---|
| Molecular Weight | 138.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 41.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.07932 |
| Heavy Atoms | 10 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 284488-23-9 |
|---|---|
| SMILES | CC1=NNC(=O)C1CC=C |
| InChIKey | HSBODWONLBSICL-UHFFFAOYSA-N |
Product Overview
3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) (CAS 284488-23-9), with molecular formula C7H10N2O and molecular weight 138.08 g/mol. IUPAC: 3-methyl-4-prop-2-enyl-1,4-dihydropyrazol-5-one.
Chemical Property Profile of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)
Property Insights of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI). With a topological polar surface area (TPSA) of 41.5 Ų, 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) 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 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)?
The CAS number of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) is 284488-23-9.
What is the molecular formula of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)?
The molecular formula of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) is C7H10N2O.
What is the molecular weight of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)?
The molecular weight of 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) is 138.08 g/mol.
Where can I buy 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI)?
You can request a quote for 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) 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-5-methyl-4-(2-propenyl)-(9CI)?
Yes, KEHONG BIO provides custom synthesis services for 3H-Pyrazol-3-one, 2,4-dihydro-5-methyl-4-(2-propenyl)-(9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.