1-(Dibromomethyl)-4-methoxy-2-nitrobenzene
TL;DR: 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene (CAS 408529-23-7) is a chemical compound with molecular formula C8H7Br2NO3 and molecular weight 322.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dibromomethyl)-4-methoxy-2-nitrobenzene
Also Known As: 1-(dibromomethyl)-4-methoxy-2-nitrobenzene, 1-(dibromomethyl)-4-methoxy-2-nitro-benzene, Benzene, 1-(dibromomethyl)-4-methoxy-2-nitro-
| Molecular Formula | C8H7Br2NO3 |
|---|---|
| Molecular Weight | 322.88 g/mol |
| LogP | 3.3918 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 322.87927 |
| Heavy Atoms | 14 |
| Complexity | 354.43967 |
Chemical Identifiers
| CAS Number | 408529-23-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(Br)Br)[N+](=O)[O-] |
Product Overview
1-(Dibromomethyl)-4-methoxy-2-nitrobenzene (CAS 408529-23-7), with molecular formula C8H7Br2NO3 and molecular weight 322.88 g/mol. IUPAC: 1-(dibromomethyl)-4-methoxy-2-nitrobenzene.
Chemical Property Profile of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene
Property Insights of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene
The XLogP value of 3.3918 indicates that 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.37 Ų, 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Dibromomethyl)-4-methoxy-2-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-(Dibromomethyl)-4-methoxy-2-nitrobenzene?
The CAS number of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene is 408529-23-7.
What is the molecular formula of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene?
The molecular formula of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene is C8H7Br2NO3.
What is the molecular weight of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene?
The molecular weight of 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene is 322.88 g/mol.
Where can I buy 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene?
You can request a quote for 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Dibromomethyl)-4-methoxy-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.