苯并[a]蒽-10,11-二醇-8,9-环氧化物 l
TL;DR: 苯并[a]蒽-10,11-二醇-8,9-环氧化物 l (CAS 63493-02-7) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯并[a]蒽-10,11-二醇-8,9-环氧化物 l
(4S,6R,7S,8R)-5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol
Also Known As: BA 10,11-Diol-8,9-epoxide l, Sid 696205, (+-)-Benz(a)anthracene-10,11-diol-8,9-epoxide, anti, (+-)-trans-8,9,10,11-Tetrahydro-10,11-dihydroxy-8-alpha,9-alpha-epoxybenz(a)anthracene, Benz(a)anthracene, 8,9,10,11-tetrahydro-10,11-dihydroxy-8-alpha,9-alpha-epoxy-, (E)-, (+-)-
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 63493-02-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=CC4=C(C=C32)[C@H]([C@@H]([C@@H]5[C@H]4O5)O)O |
| InChIKey | HZDVGGXATJSVKB-VSZNYVQBSA-N |
Product Overview
苯并[a]蒽-10,11-二醇-8,9-环氧化物 l (CAS 63493-02-7), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: (4S,6R,7S,8R)-5-oxapentacyclo[9.8.0.03,9.04,6.012,17]nonadeca-1,3(9),10,12,14,16,18-heptaene-7,8-diol.
Chemical Property Profile of 苯并[a]蒽-10,11-二醇-8,9-环氧化物 l
Property Insights of 苯并[a]蒽-10,11-二醇-8,9-环氧化物 l
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯并[a]蒽-10,11-二醇-8,9-环氧化物 l. With a topological polar surface area (TPSA) of 53.0 Ų, 苯并[a]蒽-10,11-二醇-8,9-环氧化物 l exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯并(a)蒽10,11-二醇-8,9-环氧化物l 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 苯并(a)蒽10,11-二醇-8,9-环氧化物l?
The CAS number of 苯并(a)蒽10,11-二醇-8,9-环氧化物l is 63493-02-7.
What is the molecular formula of 苯并(a)蒽10,11-二醇-8,9-环氧化物l?
The molecular formula of 苯并(a)蒽10,11-二醇-8,9-环氧化物l is C18H14O3.
What is the molecular weight of 苯并(a)蒽10,11-二醇-8,9-环氧化物l?
The molecular weight of 苯并(a)蒽10,11-二醇-8,9-环氧化物l is 278.09 g/mol.
Where can I buy 苯并(a)蒽10,11-二醇-8,9-环氧化物l?
You can request a quote for 苯并(a)蒽10,11-二醇-8,9-环氧化物l directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯并(a)蒽10,11-二醇-8,9-环氧化物l?
Yes, KEHONG BIO provides custom synthesis services for 苯并(a)蒽10,11-二醇-8,9-环氧化物l and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.