Einecs 212-697-0
TL;DR: Einecs 212-697-0 (CAS 848-07-7) is a chemical compound with molecular formula C20H22O2 and molecular weight 294.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-ethyl-3-methoxy-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-17-one
Also Known As: (1)-13-Ethyl-3-methoxygona-1,3,5(10),8,14-pentaen-17-one, (+-)-13-ethyl-3-methoxygona-1,3,5(10),8,14-pentaen-17-one, 13-ethyl-3-methoxy-6,7,11,12,13,16-hexahydro-17h-cyclopenta[a]phenanthren-17-one(non-preferred name), Gona-1,3,5(10),8,14-pentaen-17-one, 13-ethyl-3-methoxy-, (A+/-)-, 11a-Ethyl-7-methoxy-2,4,5,10,11,11a-hexahydro-1H-cyclopenta[a]phenanthren-1-one
| Molecular Formula | C20H22O2 |
|---|---|
| Molecular Weight | 294.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.162 |
| Heavy Atoms | 22 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 848-07-7 |
|---|---|
| SMILES | CCC12CCC3=C(C1=CCC2=O)CCC4=C3C=CC(=C4)OC |
| InChIKey | ZKFDNQOPOKFLFH-UHFFFAOYSA-N |
Product Overview
Einecs 212-697-0 (CAS 848-07-7), with molecular formula C20H22O2 and molecular weight 294.16 g/mol. IUPAC: 13-ethyl-3-methoxy-7,11,12,16-tetrahydro-6H-cyclopenta[a]phenanthren-17-one.
Chemical Property Profile of Einecs 212-697-0
Property Insights of Einecs 212-697-0
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 212-697-0. With a topological polar surface area (TPSA) of 26.3 Ų, Einecs 212-697-0 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Einecs 212-697-0 has 0 hydrogen bond donor(s) and 2 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 Einecs 212-697-0?
The CAS number of Einecs 212-697-0 is 848-07-7.
What is the molecular formula of Einecs 212-697-0?
The molecular formula of Einecs 212-697-0 is C20H22O2.
What is the molecular weight of Einecs 212-697-0?
The molecular weight of Einecs 212-697-0 is 294.16 g/mol.
Where can I buy Einecs 212-697-0?
You can request a quote for Einecs 212-697-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 212-697-0?
Yes, KEHONG BIO provides custom synthesis services for Einecs 212-697-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.