![3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde structure](/static/products/895/895930-21-9.png)
3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
TL;DR: 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde (CAS 895930-21-9) is a chemical compound with molecular formula C12H11ClN2O2 and molecular weight 250.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chloropyrazol-1-yl)methyl]-4-methoxybenzaldehyde
Also Known As: 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde, 3-(4-Chloro-pyrazol-1-ylmethyl)-4-methoxy-benzaldehyde, 3-[(4-chloropyrazol-1-yl)methyl]-4-methoxybenzaldehyde, BAS 13519015, 3-((4-Chloro-1H-pyrazol-1-yl)methyl)-4-methoxybenzaldehyde
| Molecular Formula | C12H11ClN2O2 |
|---|---|
| Molecular Weight | 250.05 g/mol |
| LogP | 2.4059 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.0509 |
| Heavy Atoms | 17 |
| Complexity | 537.05194 |
Chemical Identifiers
| CAS Number | 895930-21-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=O)CN2C=C(C=N2)Cl |
Product Overview
3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde (CAS 895930-21-9), with molecular formula C12H11ClN2O2 and molecular weight 250.05 g/mol. IUPAC: 3-[(4-chloropyrazol-1-yl)methyl]-4-methoxybenzaldehyde.
Chemical Property Profile of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
Property Insights of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
The XLogP value of 2.4059 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde. With a topological polar surface area (TPSA) of 44.12 Ų, 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde has 0 hydrogen bond donor(s) and 3 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 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde?
The CAS number of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde is 895930-21-9.
What is the molecular formula of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde?
The molecular formula of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde is C12H11ClN2O2.
What is the molecular weight of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde?
The molecular weight of 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde is 250.05 g/mol.
Where can I buy 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde?
You can request a quote for 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-chloro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.