Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- structure

Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-

TL;DR: Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- (CAS 220137-70-2) is a chemical compound with molecular formula C12H11BrN2O2 and molecular weight 294.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

3-[(4-bromopyrazol-1-yl)methyl]-4-methoxybenzaldehyde

Also Known As: 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde, 3-[(4-bromopyrazol-1-yl)methyl]-4-methoxybenzaldehyde, 3-((4-Bromo-1H-pyrazol-1-yl)methyl)-4-methoxybenzaldehyde, 1-Piperidin-1-ylmethyl-cyclohexylamine, 3-(4-Bromo-pyrazol-1-ylmethyl)-4-methoxy-benzaldehyde

CAS: 220137-70-2
Molecular Formula C12H11BrN2O2
Molecular Weight 294.00 g/mol
LogP 2.515
Topological Polar Surface Area 44.12 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 4
Exact Mass 294.0004
Heavy Atoms 17
Complexity 537.05194

Chemical Identifiers

CAS Number 220137-70-2
SMILES COC1=C(C=C(C=C1)C=O)CN2C=C(C=N2)Br

Product Overview

Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- (CAS 220137-70-2), with molecular formula C12H11BrN2O2 and molecular weight 294.00 g/mol. IUPAC: 3-[(4-bromopyrazol-1-yl)methyl]-4-methoxybenzaldehyde.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-

XLogP
2.515
TPSA (Topological Polar Surface Area)
44.12
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
4
Heavy Atoms
17
Complexity
537.05194
Exact Mass
294.0004
Monoisotopic Mass
294.0004
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-

The XLogP value of 2.515 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-. With a topological polar surface area (TPSA) of 44.12 Ų, Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- 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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-?

The CAS number of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- is 220137-70-2.

What is the molecular formula of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-?

The molecular formula of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- is C12H11BrN2O2.

What is the molecular weight of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-?

The molecular weight of Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- is 294.00 g/mol.

Where can I buy Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-?

You can request a quote for Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy-?

Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 3-[(4-bromo-1H-pyrazol-1-yl)methyl]-4-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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