methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate
TL;DR: methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate (CAS 430471-11-7) is a chemical compound with molecular formula C10H9NO6S and molecular weight 271.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-(2-nitrophenyl)sulfonylprop-2-enoate
Also Known As: methyl 3-(2-nitrobenzenesulfonyl)prop-2-enoate, methyl (E)-3-(2-nitrophenyl)sulfonylprop-2-enoate, methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate
| Molecular Formula | C10H9NO6S |
|---|---|
| Molecular Weight | 271.02 g/mol |
| LogP | 1.0552 |
| Topological Polar Surface Area | 103.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.01505 |
| Heavy Atoms | 18 |
| Complexity | 604.5488 |
Chemical Identifiers
| CAS Number | 430471-11-7 |
|---|---|
| SMILES | COC(=O)/C=C/S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] |
Product Overview
methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate (CAS 430471-11-7), with molecular formula C10H9NO6S and molecular weight 271.02 g/mol. IUPAC: methyl (E)-3-(2-nitrophenyl)sulfonylprop-2-enoate.
Chemical Property Profile of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate
Property Insights of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate
The XLogP value of 1.0552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate. The TPSA of 103.58 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate. Following Lipinski's Rule of Five, methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate has 0 hydrogen bond donor(s) and 6 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 methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate?
The CAS number of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate is 430471-11-7.
What is the molecular formula of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate?
The molecular formula of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate is C10H9NO6S.
What is the molecular weight of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate?
The molecular weight of methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate is 271.02 g/mol.
Where can I buy methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate?
You can request a quote for methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (2E)-3-[(2-nitrophenyl)sulfonyl]prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.