7-Chloromethyl-12-methylbenz(a)anthracene
TL;DR: 7-Chloromethyl-12-methylbenz(a)anthracene (CAS 13345-62-5) is a chemical compound with molecular formula C20H15Cl and molecular weight 290.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(chloromethyl)-12-methylbenzo[a]anthracene
Also Known As: 7-Chloromethyl-12-methylbenz(a)anthracene, 7-(chloromethyl)-12-methyltetraphene, 7-ClMe-12-MBA, 7-(chloromethyl)-12-methylbenzo[a]anthracene, Cc1c2ccccc2c(CCl)c3ccc4ccccc4c13
| Molecular Formula | C20H15Cl |
|---|---|
| Molecular Weight | 290.09 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.08624 |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 13345-62-5 |
|---|---|
| SMILES | CC1=C2C(=C(C3=CC=CC=C13)CCl)C=CC4=CC=CC=C42 |
| InChIKey | IKWYHKBBMXJHNN-UHFFFAOYSA-N |
Product Overview
7-Chloromethyl-12-methylbenz(a)anthracene (CAS 13345-62-5), with molecular formula C20H15Cl and molecular weight 290.09 g/mol. IUPAC: 7-(chloromethyl)-12-methylbenzo[a]anthracene.
Chemical Property Profile of 7-Chloromethyl-12-methylbenz(a)anthracene
Property Insights of 7-Chloromethyl-12-methylbenz(a)anthracene
The XLogP value of 5.8 indicates that 7-Chloromethyl-12-methylbenz(a)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 7-Chloromethyl-12-methylbenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloromethyl-12-methylbenz(a)anthracene 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 7-Chloromethyl-12-methylbenz(a)anthracene?
The CAS number of 7-Chloromethyl-12-methylbenz(a)anthracene is 13345-62-5.
What is the molecular formula of 7-Chloromethyl-12-methylbenz(a)anthracene?
The molecular formula of 7-Chloromethyl-12-methylbenz(a)anthracene is C20H15Cl.
What is the molecular weight of 7-Chloromethyl-12-methylbenz(a)anthracene?
The molecular weight of 7-Chloromethyl-12-methylbenz(a)anthracene is 290.09 g/mol.
Where can I buy 7-Chloromethyl-12-methylbenz(a)anthracene?
You can request a quote for 7-Chloromethyl-12-methylbenz(a)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloromethyl-12-methylbenz(a)anthracene?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloromethyl-12-methylbenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.