2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide
TL;DR: 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide (CAS 4602-14-6) is a chemical compound with molecular formula C8H11N2OP and molecular weight 182.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-1,3-dihydro-1,3,2λ5-benzodiazaphosphole 2-oxide
Also Known As: 2-ethyl-1,3-dihydro-1,3,2, 2-ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide, 2-Ethyl-2,3-dihydro-1H-1,3,2lambda~5~-benzodiazaphosphol-2-one
| Molecular Formula | C8H11N2OP |
|---|---|
| Molecular Weight | 182.06 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.0609 |
| Heavy Atoms | 12 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 4602-14-6 |
|---|---|
| SMILES | CCP1(=O)NC2=CC=CC=C2N1 |
| InChIKey | OGRAYLKIVYQXHA-UHFFFAOYSA-N |
Product Overview
2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide (CAS 4602-14-6), with molecular formula C8H11N2OP and molecular weight 182.06 g/mol. IUPAC: 2-ethyl-1,3-dihydro-1,3,2λ5-benzodiazaphosphole 2-oxide.
Chemical Property Profile of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide
Property Insights of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide. With a topological polar surface area (TPSA) of 41.1 Ų, 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide 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 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide?
The CAS number of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide is 4602-14-6.
What is the molecular formula of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide?
The molecular formula of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide is C8H11N2OP.
What is the molecular weight of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide?
The molecular weight of 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide is 182.06 g/mol.
Where can I buy 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide?
You can request a quote for 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethyl-1,3-dihydro-1,3,2lambda5-benzodiazaphosphole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.