7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene
TL;DR: 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene (CAS 80150-01-2) is a chemical compound with molecular formula C24H20O4 and molecular weight 372.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9-acetyloxy-7,12-dimethylbenzo[a]anthracen-3-yl) acetate
Also Known As: 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene, 7,12-Dimethyltetraphene-3,9-diyl diacetate, 7,12-Dimethylbenz(a)anthracene-3,9-diol diacetate (ester), BENZ(a)ANTHRACENE-3,9-DIOL, 7,12-DIMETHYL-, DIACETATE (ester), (9-acetyloxy-7,12-dimethylbenzo[a]anthracen-3-yl) acetate
| Molecular Formula | C24H20O4 |
|---|---|
| Molecular Weight | 372.14 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 372.13617 |
| Heavy Atoms | 28 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 80150-01-2 |
|---|---|
| SMILES | CC1=C2C=CC3=C(C2=C(C4=C1C=C(C=C4)OC(=O)C)C)C=CC(=C3)OC(=O)C |
| InChIKey | CABXEAJDBBIAPB-UHFFFAOYSA-N |
Product Overview
7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene (CAS 80150-01-2), with molecular formula C24H20O4 and molecular weight 372.14 g/mol. IUPAC: (9-acetyloxy-7,12-dimethylbenzo[a]anthracen-3-yl) acetate.
Chemical Property Profile of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene
Property Insights of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene
The XLogP value of 5.9 indicates that 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene?
The CAS number of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene is 80150-01-2.
What is the molecular formula of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene?
The molecular formula of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene is C24H20O4.
What is the molecular weight of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene?
The molecular weight of 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene is 372.14 g/mol.
Where can I buy 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene?
You can request a quote for 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene?
Yes, KEHONG BIO provides custom synthesis services for 7,12-Dimethyl-3,9-diacetoxybenz(a)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.