![1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene structure](/static/products/3119/31191-41-0.webp)
1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene
TL;DR: 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene (CAS 31191-41-0) is a chemical compound with molecular formula C14H11BrClNO3 and molecular weight 354.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4-(bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene
Also Known As: 1-[[4-(bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene, 1-{[4-(BROMOMETHYL)PHENYL]METHOXY}-2-CHLORO-4-NITROBENZENE
| Molecular Formula | C14H11BrClNO3 |
|---|---|
| Molecular Weight | 354.96 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 354.9611 |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 31191-41-0 |
|---|---|
| SMILES | C1=CC(=CC=C1COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)CBr |
| InChIKey | WVZKPGNNQYMZMW-UHFFFAOYSA-N |
Product Overview
1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene (CAS 31191-41-0), with molecular formula C14H11BrClNO3 and molecular weight 354.96 g/mol. IUPAC: 1-[[4-(bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene.
Chemical Property Profile of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene
Property Insights of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene
The XLogP value of 4.4 indicates that 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene 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 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene?
The CAS number of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene is 31191-41-0.
What is the molecular formula of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene?
The molecular formula of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene is C14H11BrClNO3.
What is the molecular weight of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene?
The molecular weight of 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene is 354.96 g/mol.
Where can I buy 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene?
You can request a quote for 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[[4-(Bromomethyl)phenyl]methoxy]-2-chloro-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.