CAS 21038-31-3 - C12H7Cl5O2
TL;DR: CAS 21038-31-3 - C12H7Cl5O2 (CAS 21038-31-3) is a chemical compound with molecular formula C12H7Cl5O2 and molecular weight 357.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,10S,11R,13S)-3,5,6,6,7-pentachloro-12-oxahexacyclo[6.5.0.02,10.03,7.05,9.011,13]tridecan-4-one
Also Known As: 2,4,6-Metheno-5H-cyclopenta[4,5]pentaleno[1,2-b]oxiren-5-one, 2a,3,3,4,5a-pentachlorodecahydro-, (1aS,1bR,6R,6aR)-
| Molecular Formula | C12H7Cl5O2 |
|---|---|
| Molecular Weight | 357.89 g/mol |
| LogP | 2.5786 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 357.88885 |
| Heavy Atoms | 19 |
| Complexity | 598.9272 |
Chemical Identifiers
| CAS Number | 21038-31-3 |
|---|---|
| SMILES | [C@@H]12[C@@H](O1)[C@@H]3C4[C@H]2C5C3C6(C4(C(=O)C5(C6(Cl)Cl)Cl)Cl)Cl |
Product Overview
CAS 21038-31-3 - C12H7Cl5O2 (CAS 21038-31-3), with molecular formula C12H7Cl5O2 and molecular weight 357.89 g/mol. IUPAC: (1R,10S,11R,13S)-3,5,6,6,7-pentachloro-12-oxahexacyclo[6.5.0.02,10.03,7.05,9.011,13]tridecan-4-one.
Chemical Property Profile of CAS 21038-31-3 - C12H7Cl5O2
Property Insights of CAS 21038-31-3 - C12H7Cl5O2
The XLogP value of 2.5786 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CAS 21038-31-3 - C12H7Cl5O2. With a topological polar surface area (TPSA) of 29.6 Ų, CAS 21038-31-3 - C12H7Cl5O2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CAS 21038-31-3 - C12H7Cl5O2 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 CAS 21038-31-3 - C12H7Cl5O2?
The CAS number of CAS 21038-31-3 - C12H7Cl5O2 is 21038-31-3.
What is the molecular formula of CAS 21038-31-3 - C12H7Cl5O2?
The molecular formula of CAS 21038-31-3 - C12H7Cl5O2 is C12H7Cl5O2.
What is the molecular weight of CAS 21038-31-3 - C12H7Cl5O2?
The molecular weight of CAS 21038-31-3 - C12H7Cl5O2 is 357.89 g/mol.
Where can I buy CAS 21038-31-3 - C12H7Cl5O2?
You can request a quote for CAS 21038-31-3 - C12H7Cl5O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 21038-31-3 - C12H7Cl5O2?
Yes, KEHONG BIO provides custom synthesis services for CAS 21038-31-3 - C12H7Cl5O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.