2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester
TL;DR: 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester (CAS 87776-96-3) is a chemical compound with molecular formula C15H25NO4 and molecular weight 283.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-7-(3-acetyl-1,3-oxazolidin-2-yl)-2,6-dimethylhept-2-enoate
Also Known As: 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester, Methyl (E)-7-(3-acetyl-1,3-oxazolidin-2-yl)-2,6-dimethyl-hept-2-enoate, methyl (E)-7-(3-acetyl-1,3-oxazolidin-2-yl)-2,6-dimethylhept-2-enoate
| Molecular Formula | C15H25NO4 |
|---|---|
| Molecular Weight | 283.18 g/mol |
| LogP | 2.1169 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 283.17834 |
| Heavy Atoms | 20 |
| Complexity | 378.0698 |
Chemical Identifiers
| CAS Number | 87776-96-3 |
|---|---|
| SMILES | CC(CC/C=C(\C)/C(=O)OC)CC1N(CCO1)C(=O)C |
Product Overview
2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester (CAS 87776-96-3), with molecular formula C15H25NO4 and molecular weight 283.18 g/mol. IUPAC: methyl (E)-7-(3-acetyl-1,3-oxazolidin-2-yl)-2,6-dimethylhept-2-enoate.
Chemical Property Profile of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester
Property Insights of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester
The XLogP value of 2.1169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester. With a topological polar surface area (TPSA) of 55.84 Ų, 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester 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 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester?
The CAS number of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester is 87776-96-3.
What is the molecular formula of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester?
The molecular formula of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester is C15H25NO4.
What is the molecular weight of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester?
The molecular weight of 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester is 283.18 g/mol.
Where can I buy 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester?
You can request a quote for 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Heptenoic acid, 7-(3-acetyl-2-oxazolidinyl)-2,6-dimethyl-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.