(+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene
TL;DR: (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene (CAS 117022-35-2) is a chemical compound with molecular formula C20H18O3 and molecular weight 306.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16,19-dimethyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol
Also Known As: 5,7-diMeC-1,2-dihydroxy-3,4-epoxide, anti-5,7-Dimethylchrysene-1,2-diol-3,4-epoxide, 1,2-Dihydroxy-5,7-dimethyl-3,4-epoxy-1,2,3,4-tetrahydrochrysene, anti-1,2,3,4-Tetrahydro-5,7-dimethylchrysene-1,2-diol-3,4-epoxide, (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene
| Molecular Formula | C20H18O3 |
|---|---|
| Molecular Weight | 306.13 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 306.12558 |
| Heavy Atoms | 23 |
| Complexity | 480.0 |
Chemical Identifiers
| CAS Number | 117022-35-2 |
|---|---|
| SMILES | CC1=C2C=C(C3=C(C2=CC=C1)C=CC4=C3C5C(O5)C(C4O)O)C |
| InChIKey | WJNMOHJPMIXLHU-UHFFFAOYSA-N |
Product Overview
(+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene (CAS 117022-35-2), with molecular formula C20H18O3 and molecular weight 306.13 g/mol. IUPAC: 16,19-dimethyl-4-oxapentacyclo[9.8.0.02,8.03,5.012,17]nonadeca-1(11),2(8),9,12,14,16,18-heptaene-6,7-diol.
Chemical Property Profile of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene
Property Insights of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene
The XLogP value of 3.0 indicates that (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.0 Ų, (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene?
The CAS number of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene is 117022-35-2.
What is the molecular formula of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene?
The molecular formula of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene is C20H18O3.
What is the molecular weight of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene?
The molecular weight of (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene is 306.13 g/mol.
Where can I buy (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene?
You can request a quote for (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene?
Yes, KEHONG BIO provides custom synthesis services for (+/-)-anti-1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydro-5,7-dimethylchrysene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.