7-Methylbenz(a)anthracene-10-carbonitrile
TL;DR: 7-Methylbenz(a)anthracene-10-carbonitrile (CAS 6366-23-0) is a chemical compound with molecular formula C20H13N and molecular weight 267.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methylbenzo[a]anthracene-10-carbonitrile
Also Known As: Octan-2-sulfate, Octyl-2-sulfate, 7-methyltetraphene-10-carbonitrile, Potassium octan-2-sulfate, 7-Methylbenz(a)anthracene-10-carbonitrile
| Molecular Formula | C20H13N |
|---|---|
| Molecular Weight | 267.10 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 267.1048 |
| Heavy Atoms | 21 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 6366-23-0 |
|---|---|
| SMILES | CC1=C2C=CC(=CC2=CC3=C1C=CC4=CC=CC=C43)C#N |
| InChIKey | BYWGQAGELPWCLZ-UHFFFAOYSA-N |
Product Overview
7-Methylbenz(a)anthracene-10-carbonitrile (CAS 6366-23-0), with molecular formula C20H13N and molecular weight 267.10 g/mol. IUPAC: 7-methylbenzo[a]anthracene-10-carbonitrile.
Chemical Property Profile of 7-Methylbenz(a)anthracene-10-carbonitrile
Property Insights of 7-Methylbenz(a)anthracene-10-carbonitrile
The XLogP value of 5.8 indicates that 7-Methylbenz(a)anthracene-10-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 7-Methylbenz(a)anthracene-10-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methylbenz(a)anthracene-10-carbonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7-Methylbenz(a)anthracene-10-carbonitrile?
The CAS number of 7-Methylbenz(a)anthracene-10-carbonitrile is 6366-23-0.
What is the molecular formula of 7-Methylbenz(a)anthracene-10-carbonitrile?
The molecular formula of 7-Methylbenz(a)anthracene-10-carbonitrile is C20H13N.
What is the molecular weight of 7-Methylbenz(a)anthracene-10-carbonitrile?
The molecular weight of 7-Methylbenz(a)anthracene-10-carbonitrile is 267.10 g/mol.
Where can I buy 7-Methylbenz(a)anthracene-10-carbonitrile?
You can request a quote for 7-Methylbenz(a)anthracene-10-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methylbenz(a)anthracene-10-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 7-Methylbenz(a)anthracene-10-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.