Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate
TL;DR: Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate (CAS 71988-98-2) is a chemical compound with molecular formula C22H18O3 and molecular weight 330.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methoxy-7-methylbenzo[a]anthracen-12-yl) acetate
Also Known As: Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate, 3-METHOXY-7-METHYLTETRAPHEN-12-YL ACETATE, (3-methoxy-7-methylbenzo[a]anthracen-12-yl) acetate
| Molecular Formula | C22H18O3 |
|---|---|
| Molecular Weight | 330.13 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.12558 |
| Heavy Atoms | 25 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 71988-98-2 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=C(C4=CC=CC=C14)OC(=O)C)C=CC(=C3)OC |
| InChIKey | ABEDWQQSWQXBBO-UHFFFAOYSA-N |
Product Overview
Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate (CAS 71988-98-2), with molecular formula C22H18O3 and molecular weight 330.13 g/mol. IUPAC: (3-methoxy-7-methylbenzo[a]anthracen-12-yl) acetate.
Chemical Property Profile of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate
Property Insights of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate
The XLogP value of 5.8 indicates that Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate?
The CAS number of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate is 71988-98-2.
What is the molecular formula of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate?
The molecular formula of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate is C22H18O3.
What is the molecular weight of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate?
The molecular weight of Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate is 330.13 g/mol.
Where can I buy Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate?
You can request a quote for Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Benz(a)anthracen-12-ol, 3-methoxy-7-methyl-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.