五氟化钒
TL;DR: 五氟化钒 (CAS 7783-72-4) is a chemical compound with molecular formula C12H17NO2S and molecular weight 239.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
五氟化钒
ethyl (6R)-2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: ethyl(6r)-2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl (6R)-2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C12H17NO2S |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 80.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.098 |
| Heavy Atoms | 16 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 7783-72-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)N |
| InChIKey | WSOISFMHBFFWRQ-SSDOTTSWSA-N |
Product Overview
五氟化钒 (CAS 7783-72-4), with molecular formula C12H17NO2S and molecular weight 239.10 g/mol. IUPAC: ethyl (6R)-2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of 五氟化钒
Property Insights of 五氟化钒
The XLogP value of 3.7 indicates that 五氟化钒 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 五氟化钒. Following Lipinski's Rule of Five, 五氟化钒 has 1 hydrogen bond donor(s) and 4 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 五氟化钒?
The CAS number of 五氟化钒 is 7783-72-4.
What is the molecular formula of 五氟化钒?
The molecular formula of 五氟化钒 is C12H17NO2S.
What is the molecular weight of 五氟化钒?
The molecular weight of 五氟化钒 is 239.10 g/mol.
Where can I buy 五氟化钒?
You can request a quote for 五氟化钒 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 五氟化钒?
Yes, KEHONG BIO provides custom synthesis services for 五氟化钒 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.