![Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate structure](/static/products/813/81396-51-2.png)
Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
TL;DR: Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate (CAS 81396-51-2) is a chemical compound with molecular formula C7H11NO3 and molecular weight 157.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
Also Known As: methyl 7-oxa-4-azabicyclo[4.1.0]heptane-4-carboxylate, METHYL 7-OXA-3-AZABICYCLO[4.1.0]HEPTANE-3-CARBOXYLATE, 7-OXA-3-AZABICYCLO[4.1.0]HEPTANE-3-CARBOXYLICACID, METHYL ESTER
| Molecular Formula | C7H11NO3 |
|---|---|
| Molecular Weight | 157.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.0739 |
| Heavy Atoms | 11 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 81396-51-2 |
|---|---|
| SMILES | COC(=O)N1CCC2C(C1)O2 |
| InChIKey | WLUWMOPCTUGBSD-UHFFFAOYSA-N |
Product Overview
Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate (CAS 81396-51-2), with molecular formula C7H11NO3 and molecular weight 157.07 g/mol. IUPAC: methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate.
Chemical Property Profile of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
Property Insights of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate. With a topological polar surface area (TPSA) of 42.1 Ų, Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate has 0 hydrogen bond donor(s) and 3 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 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate?
The CAS number of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate is 81396-51-2.
What is the molecular formula of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate?
The molecular formula of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate is C7H11NO3.
What is the molecular weight of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate?
The molecular weight of Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate is 157.07 g/mol.
Where can I buy Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate?
You can request a quote for Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 7-oxa-3-azabicyclo[4.1.0]heptane-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.