6-Bromomethylanthanthrene
TL;DR: 6-Bromomethylanthanthrene (CAS 115744-13-3) is a chemical compound with molecular formula C23H13Br and molecular weight 368.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12-(bromomethyl)hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaene
Also Known As: 6-Bromomethylanthanthrene, Dibenzo[def,mno]chrysene,6-(bromomethyl)-, NIOSH/HO6200000, 6-Bromomethyldibenzo(def,mno)chrysene, dibenzo[def,mno]chrysene, 6-(bromomethyl)-
| Molecular Formula | C23H13Br |
|---|---|
| Molecular Weight | 368.02 g/mol |
| LogP | 7.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 368.02005 |
| Heavy Atoms | 24 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 115744-13-3 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=C4C=CC5=C6C4=C3C(=C(C6=CC=C5)CBr)C=C2 |
| InChIKey | OGWGPENEZHHLHI-UHFFFAOYSA-N |
Product Overview
6-Bromomethylanthanthrene (CAS 115744-13-3), with molecular formula C23H13Br and molecular weight 368.02 g/mol. IUPAC: 12-(bromomethyl)hexacyclo[11.7.1.14,20.02,11.03,8.017,21]docosa-1,3(8),4,6,9,11,13,15,17(21),18,20(22)-undecaene.
Chemical Property Profile of 6-Bromomethylanthanthrene
Property Insights of 6-Bromomethylanthanthrene
The XLogP value of 7.4 indicates that 6-Bromomethylanthanthrene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 6-Bromomethylanthanthrene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromomethylanthanthrene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Bromomethylanthanthrene?
The CAS number of 6-Bromomethylanthanthrene is 115744-13-3.
What is the molecular formula of 6-Bromomethylanthanthrene?
The molecular formula of 6-Bromomethylanthanthrene is C23H13Br.
What is the molecular weight of 6-Bromomethylanthanthrene?
The molecular weight of 6-Bromomethylanthanthrene is 368.02 g/mol.
Where can I buy 6-Bromomethylanthanthrene?
You can request a quote for 6-Bromomethylanthanthrene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromomethylanthanthrene?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromomethylanthanthrene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.