3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene
TL;DR: 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene (CAS 114326-36-2) is a chemical compound with molecular formula C24H20O2 and molecular weight 340.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7S,8S)-2,13-dimethylpentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,10,13,15,17,19,21-decaene-7,8-diol
Also Known As: 3,4-Dddba, 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene, 7,14-Dimethyldibenz(a,j)anthracene-3,4-dihydrodiol, 3,4-Dihydrodihydroxy-7,14-dimethylbenz(a,j)anthracene, 7,14-Dimethyl-3,4-dihydrobenzo[m]tetraphene-3,4-diol
| Molecular Formula | C24H20O2 |
|---|---|
| Molecular Weight | 340.15 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 340.14633 |
| Heavy Atoms | 26 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 114326-36-2 |
|---|---|
| SMILES | CC1=C2C=CC3=CC=CC=C3C2=C(C4=C1C=CC5=C4C=C[C@@H]([C@H]5O)O)C |
| InChIKey | BPFPSSKWNSYDEY-URXFXBBRSA-N |
Product Overview
3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene (CAS 114326-36-2), with molecular formula C24H20O2 and molecular weight 340.15 g/mol. IUPAC: (7S,8S)-2,13-dimethylpentacyclo[12.8.0.03,12.04,9.017,22]docosa-1,3(12),4(9),5,10,13,15,17,19,21-decaene-7,8-diol.
Chemical Property Profile of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene
Property Insights of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene
The XLogP value of 5.3 indicates that 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene?
The CAS number of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene is 114326-36-2.
What is the molecular formula of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene?
The molecular formula of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene is C24H20O2.
What is the molecular weight of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene?
The molecular weight of 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene is 340.15 g/mol.
Where can I buy 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene?
You can request a quote for 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydrodiol-7,14-dimethylbenz(a,j)anthracene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.