7,8,12-Trimethylbenz(a)anthracene
TL;DR: 7,8,12-Trimethylbenz(a)anthracene (CAS 13345-64-7) is a chemical compound with molecular formula C21H18 and molecular weight 270.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,8,12-trimethylbenzo[a]anthracene
Also Known As: 7,8,12-Trimethylbenz(a)anthracene, 7,8,12-TMBA, 7,8,12-Trimethylbenz[a]anthracene, 7,8,12-trimethylbenzo[a]anthracene, 5:9:10-Trimethyl-1:2-benzanthracene
| Molecular Formula | C21H18 |
|---|---|
| Molecular Weight | 270.14 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.14084 |
| Heavy Atoms | 21 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 13345-64-7 |
|---|---|
| SMILES | CC1=C2C(=C3C=CC4=CC=CC=C4C3=C(C2=CC=C1)C)C |
| InChIKey | NQIIOABBGPROQW-UHFFFAOYSA-N |
Product Overview
7,8,12-Trimethylbenz(a)anthracene (CAS 13345-64-7), with molecular formula C21H18 and molecular weight 270.14 g/mol. IUPAC: 7,8,12-trimethylbenzo[a]anthracene.
Chemical Property Profile of 7,8,12-Trimethylbenz(a)anthracene
Property Insights of 7,8,12-Trimethylbenz(a)anthracene
The XLogP value of 6.2 indicates that 7,8,12-Trimethylbenz(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, 7,8,12-Trimethylbenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,8,12-Trimethylbenz(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 7,8,12-Trimethylbenz(a)anthracene?
The CAS number of 7,8,12-Trimethylbenz(a)anthracene is 13345-64-7.
What is the molecular formula of 7,8,12-Trimethylbenz(a)anthracene?
The molecular formula of 7,8,12-Trimethylbenz(a)anthracene is C21H18.
What is the molecular weight of 7,8,12-Trimethylbenz(a)anthracene?
The molecular weight of 7,8,12-Trimethylbenz(a)anthracene is 270.14 g/mol.
Where can I buy 7,8,12-Trimethylbenz(a)anthracene?
You can request a quote for 7,8,12-Trimethylbenz(a)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,8,12-Trimethylbenz(a)anthracene?
Yes, KEHONG BIO provides custom synthesis services for 7,8,12-Trimethylbenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.