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Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate
TL;DR: Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate (CAS 35690-71-2) is a chemical compound with molecular formula C12H17NO4 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate
Also Known As: Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate, Methyl (3,4-dimethoxyphenethyl)carbamate, J1.488.138G, 3,4-Dimethoxyphenethylamine, N-methoxycarbonyl-, 3,4-Dimethoxyphenethylcarbamic acid methyl ester
| Molecular Formula | C12H17NO4 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 1.6023 |
| Topological Polar Surface Area | 56.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.11575 |
| Heavy Atoms | 17 |
| Complexity | 378.76843 |
Chemical Identifiers
| CAS Number | 35690-71-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)OC)OC |
Product Overview
Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate (CAS 35690-71-2), with molecular formula C12H17NO4 and molecular weight 239.12 g/mol. IUPAC: methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate.
Chemical Property Profile of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate
Property Insights of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate
The XLogP value of 1.6023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate. With a topological polar surface area (TPSA) of 56.79 Ų, Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate has 1 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 Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate?
The CAS number of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate is 35690-71-2.
What is the molecular formula of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate?
The molecular formula of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate is C12H17NO4.
What is the molecular weight of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate?
The molecular weight of Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate is 239.12 g/mol.
Where can I buy Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate?
You can request a quote for Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-[2-(3,4-dimethoxyphenyl)ethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.