7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate
TL;DR: 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate (CAS 7239-52-3) is a chemical compound with molecular formula C16H19NO5S and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-prop-1-en-2-yl-7-bicyclo[4.1.0]heptanyl) 4-nitrobenzenesulfonate
Also Known As: 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate, (7-prop-1-en-2-yl-7-bicyclo[4.1.0]heptanyl) 4-nitrobenzenesulfonate, 7-(4-nitrophenyl)sulfonyloxy-7-prop-1-en-2-yl-bicyclo[4.1.0]heptane
| Molecular Formula | C16H19NO5S |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | 3.435 |
| Topological Polar Surface Area | 86.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.0984 |
| Heavy Atoms | 23 |
| Complexity | 741.1802 |
Chemical Identifiers
| CAS Number | 7239-52-3 |
|---|---|
| SMILES | CC(=C)C1(C2C1CCCC2)OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate (CAS 7239-52-3), with molecular formula C16H19NO5S and molecular weight 337.10 g/mol. IUPAC: (7-prop-1-en-2-yl-7-bicyclo[4.1.0]heptanyl) 4-nitrobenzenesulfonate.
Chemical Property Profile of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate
Property Insights of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate
The XLogP value of 3.435 indicates that 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate. Following Lipinski's Rule of Five, 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate has 0 hydrogen bond donor(s) and 5 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 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate?
The CAS number of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate is 7239-52-3.
What is the molecular formula of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate?
The molecular formula of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate is C16H19NO5S.
What is the molecular weight of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate?
The molecular weight of 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate is 337.10 g/mol.
Where can I buy 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate?
You can request a quote for 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 7-(Prop-1-en-2-yl)bicyclo[4.1.0]heptan-7-yl 4-nitrobenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.