methyl N-1,3-benzodioxol-5-ylglycinate
TL;DR: methyl N-1,3-benzodioxol-5-ylglycinate (CAS 126132-93-2) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(1,3-benzodioxol-5-ylamino)acetate
Also Known As: TimTec1_007464, methyl N-1,3-benzodioxol-5-ylglycinate, methyl 2-[(1,3-dioxaindan-5-yl)amino]acetate, IDI1_033118, BAS 06662307
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 1.0002 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 377.68518 |
Chemical Identifiers
| CAS Number | 126132-93-2 |
|---|---|
| SMILES | COC(=O)CNC1=CC2=C(C=C1)OCO2 |
Product Overview
methyl N-1,3-benzodioxol-5-ylglycinate (CAS 126132-93-2), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: methyl 2-(1,3-benzodioxol-5-ylamino)acetate.
Chemical Property Profile of methyl N-1,3-benzodioxol-5-ylglycinate
Property Insights of methyl N-1,3-benzodioxol-5-ylglycinate
The XLogP value of 1.0002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-1,3-benzodioxol-5-ylglycinate. With a topological polar surface area (TPSA) of 56.79 Ų, methyl N-1,3-benzodioxol-5-ylglycinate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-1,3-benzodioxol-5-ylglycinate has 1 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 methyl N-1,3-benzodioxol-5-ylglycinate?
The CAS number of methyl N-1,3-benzodioxol-5-ylglycinate is 126132-93-2.
What is the molecular formula of methyl N-1,3-benzodioxol-5-ylglycinate?
The molecular formula of methyl N-1,3-benzodioxol-5-ylglycinate is C10H11NO4.
What is the molecular weight of methyl N-1,3-benzodioxol-5-ylglycinate?
The molecular weight of methyl N-1,3-benzodioxol-5-ylglycinate is 209.07 g/mol.
Where can I buy methyl N-1,3-benzodioxol-5-ylglycinate?
You can request a quote for methyl N-1,3-benzodioxol-5-ylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-1,3-benzodioxol-5-ylglycinate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-1,3-benzodioxol-5-ylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.