1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene
TL;DR: 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene (CAS 1155-38-0) is a chemical compound with molecular formula C19H14O and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
19-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.013,18]nonadeca-1(19),5,7,9,11,13,15,17-octaene
Also Known As: 7-Methylbenzanthracene 5,6-oxide, 7-Methylbenz(a)anthracene-5,6-oxide, 7-Methylbenz(a)anthracene 5,6 oxide, 7-Methylbenz(a)anthracene 5,6-oxide, 7-Methylbenz[a]anthracene 5,6-oxide
| Molecular Formula | C19H14O |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 258.10446 |
| Heavy Atoms | 20 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 1155-38-0 |
|---|---|
| SMILES | CC1=C2C3C(O3)C4=CC=CC=C4C2=CC5=CC=CC=C15 |
| InChIKey | MFBSRFKHKCKLIC-UHFFFAOYSA-N |
Product Overview
1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene (CAS 1155-38-0), with molecular formula C19H14O and molecular weight 258.10 g/mol. IUPAC: 19-methyl-3-oxapentacyclo[9.8.0.02,4.05,10.013,18]nonadeca-1(19),5,7,9,11,13,15,17-octaene.
Chemical Property Profile of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene
Property Insights of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene
The XLogP value of 4.2 indicates that 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene has 0 hydrogen bond donor(s) and 1 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 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene?
The CAS number of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene is 1155-38-0.
What is the molecular formula of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene?
The molecular formula of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene is C19H14O.
What is the molecular weight of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene?
The molecular weight of 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene is 258.10 g/mol.
Where can I buy 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene?
You can request a quote for 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene?
Yes, KEHONG BIO provides custom synthesis services for 1a,11b-Dihydro-11-methylbenz(a)anthra(5,6-b)oxirene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.