![2-[(Dimethylamino)methyl]phenyl dimethylcarbamate structure](/static/products/7710/77104-67-7.webp)
2-[(Dimethylamino)methyl]phenyl dimethylcarbamate
TL;DR: 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate (CAS 77104-67-7) is a chemical compound with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(dimethylamino)methyl]phenyl] N,N-dimethylcarbamate
Also Known As: 2-[(dimethylamino)methyl]phenyl dimethylcarbamate, [2-(dimethylaminomethyl)phenyl] N,N-dimethylcarbamate, 2-((dimethylamino)methyl)phenyl dimethylcarbamate, AO-365/40892239, [2-[(dimethylamino)methyl]phenyl] N,N-dimethylcarbamate
| Molecular Formula | C12H18N2O2 |
|---|---|
| Molecular Weight | 222.14 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.13683 |
| Heavy Atoms | 16 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 77104-67-7 |
|---|---|
| SMILES | CN(C)CC1=CC=CC=C1OC(=O)N(C)C |
| InChIKey | FWGOSWYGZCZRTD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(Dimethylamino)methyl]phenyl dimethylcarbamate (CAS 77104-67-7), with molecular formula C12H18N2O2 and molecular weight 222.14 g/mol. IUPAC: [2-[(dimethylamino)methyl]phenyl] N,N-dimethylcarbamate.
Chemical Property Profile of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate
Property Insights of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate. With a topological polar surface area (TPSA) of 32.8 Ų, 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate 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 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate?
The CAS number of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate is 77104-67-7.
What is the molecular formula of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate?
The molecular formula of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate is C12H18N2O2.
What is the molecular weight of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate?
The molecular weight of 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate is 222.14 g/mol.
Where can I buy 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate?
You can request a quote for 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Dimethylamino)methyl]phenyl dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.