4-(1H-pyrazol-1-yl)benzoyl chloride
TL;DR: 4-(1H-pyrazol-1-yl)benzoyl chloride (CAS 220461-83-6) is a chemical compound with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-pyrazol-1-ylbenzoyl chloride
Also Known As: 4-(1H-pyrazol-1-yl)benzoyl chloride, 4-pyrazol-1-ylbenzoyl chloride, 4-pyrazolylbenzoyl chloride, 4-(pyrazol-1-yl)benzoyl chloride, 4- BENZOYLCHLORIDE
| Molecular Formula | C10H7ClN2O |
|---|---|
| Molecular Weight | 206.02 g/mol |
| LogP | 2.2513 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.02469 |
| Heavy Atoms | 14 |
| Complexity | 433.65536 |
Chemical Identifiers
| CAS Number | 220461-83-6 |
|---|---|
| SMILES | C1=CN(N=C1)C2=CC=C(C=C2)C(=O)Cl |
Product Overview
4-(1H-pyrazol-1-yl)benzoyl chloride (CAS 220461-83-6), with molecular formula C10H7ClN2O and molecular weight 206.02 g/mol. IUPAC: 4-pyrazol-1-ylbenzoyl chloride.
Chemical Property Profile of 4-(1H-pyrazol-1-yl)benzoyl chloride
Property Insights of 4-(1H-pyrazol-1-yl)benzoyl chloride
The XLogP value of 2.2513 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1H-pyrazol-1-yl)benzoyl chloride. With a topological polar surface area (TPSA) of 34.89 Ų, 4-(1H-pyrazol-1-yl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1H-pyrazol-1-yl)benzoyl chloride 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 4-(1H-pyrazol-1-yl)benzoyl chloride?
The CAS number of 4-(1H-pyrazol-1-yl)benzoyl chloride is 220461-83-6.
What is the molecular formula of 4-(1H-pyrazol-1-yl)benzoyl chloride?
The molecular formula of 4-(1H-pyrazol-1-yl)benzoyl chloride is C10H7ClN2O.
What is the molecular weight of 4-(1H-pyrazol-1-yl)benzoyl chloride?
The molecular weight of 4-(1H-pyrazol-1-yl)benzoyl chloride is 206.02 g/mol.
Where can I buy 4-(1H-pyrazol-1-yl)benzoyl chloride?
You can request a quote for 4-(1H-pyrazol-1-yl)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1H-pyrazol-1-yl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 4-(1H-pyrazol-1-yl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.