4-Bromo-1-methyl-2-nitronaphthalene
TL;DR: 4-Bromo-1-methyl-2-nitronaphthalene (CAS 63017-86-7) is a chemical compound with molecular formula C11H8BrNO2 and molecular weight 264.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-methyl-2-nitronaphthalene
Also Known As: 4-bromo-1-methyl-2-nitronaphthalene, 4-bromo-1-methyl-2-nitro-naphthalene, 816-522-4, RefChem:290514
| Molecular Formula | C11H8BrNO2 |
|---|---|
| Molecular Weight | 264.97 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.97385 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 63017-86-7 |
|---|---|
| SMILES | CC1=C(C=C(C2=CC=CC=C12)Br)[N+](=O)[O-] |
| InChIKey | SIGLNJPRJCTIDS-UHFFFAOYSA-N |
Product Overview
4-Bromo-1-methyl-2-nitronaphthalene (CAS 63017-86-7), with molecular formula C11H8BrNO2 and molecular weight 264.97 g/mol. IUPAC: 4-bromo-1-methyl-2-nitronaphthalene.
Chemical Property Profile of 4-Bromo-1-methyl-2-nitronaphthalene
Property Insights of 4-Bromo-1-methyl-2-nitronaphthalene
The XLogP value of 4.1 indicates that 4-Bromo-1-methyl-2-nitronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 4-Bromo-1-methyl-2-nitronaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-1-methyl-2-nitronaphthalene 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-Bromo-1-methyl-2-nitronaphthalene?
The CAS number of 4-Bromo-1-methyl-2-nitronaphthalene is 63017-86-7.
What is the molecular formula of 4-Bromo-1-methyl-2-nitronaphthalene?
The molecular formula of 4-Bromo-1-methyl-2-nitronaphthalene is C11H8BrNO2.
What is the molecular weight of 4-Bromo-1-methyl-2-nitronaphthalene?
The molecular weight of 4-Bromo-1-methyl-2-nitronaphthalene is 264.97 g/mol.
Where can I buy 4-Bromo-1-methyl-2-nitronaphthalene?
You can request a quote for 4-Bromo-1-methyl-2-nitronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-1-methyl-2-nitronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-1-methyl-2-nitronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.