(Z)-Methyl 2-nitro-3-phenylpropenoate
TL;DR: (Z)-Methyl 2-nitro-3-phenylpropenoate (CAS 42251-12-7) is a chemical compound with molecular formula C10H9NO4 and molecular weight 207.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (Z)-3-nitro-3-phenylprop-2-enoate
Also Known As: (Z)-Methyl 2-nitro-3-phenylpropenoate, (Z) Methyl 2-nitro-3-phenylpropenoate, methyl (Z)-3-nitro-3-phenylprop-2-enoate
| Molecular Formula | C10H9NO4 |
|---|---|
| Molecular Weight | 207.05 g/mol |
| LogP | 1.4772 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.05316 |
| Heavy Atoms | 15 |
| Complexity | 397.14322 |
Chemical Identifiers
| CAS Number | 42251-12-7 |
|---|---|
| SMILES | COC(=O)/C=C(/C1=CC=CC=C1)\[N+](=O)[O-] |
Product Overview
(Z)-Methyl 2-nitro-3-phenylpropenoate (CAS 42251-12-7), with molecular formula C10H9NO4 and molecular weight 207.05 g/mol. IUPAC: methyl (Z)-3-nitro-3-phenylprop-2-enoate.
Chemical Property Profile of (Z)-Methyl 2-nitro-3-phenylpropenoate
Property Insights of (Z)-Methyl 2-nitro-3-phenylpropenoate
The XLogP value of 1.4772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-Methyl 2-nitro-3-phenylpropenoate. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-Methyl 2-nitro-3-phenylpropenoate. Following Lipinski's Rule of Five, (Z)-Methyl 2-nitro-3-phenylpropenoate has 0 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 (Z)-Methyl 2-nitro-3-phenylpropenoate?
The CAS number of (Z)-Methyl 2-nitro-3-phenylpropenoate is 42251-12-7.
What is the molecular formula of (Z)-Methyl 2-nitro-3-phenylpropenoate?
The molecular formula of (Z)-Methyl 2-nitro-3-phenylpropenoate is C10H9NO4.
What is the molecular weight of (Z)-Methyl 2-nitro-3-phenylpropenoate?
The molecular weight of (Z)-Methyl 2-nitro-3-phenylpropenoate is 207.05 g/mol.
Where can I buy (Z)-Methyl 2-nitro-3-phenylpropenoate?
You can request a quote for (Z)-Methyl 2-nitro-3-phenylpropenoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-Methyl 2-nitro-3-phenylpropenoate?
Yes, KEHONG BIO provides custom synthesis services for (Z)-Methyl 2-nitro-3-phenylpropenoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.