Dimethylcarbamic acid 2-acetylphenyl ester
TL;DR: Dimethylcarbamic acid 2-acetylphenyl ester (CAS 29230-99-7) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetylphenyl) N,N-dimethylcarbamate
Also Known As: Dimethylcarbamic acid 2-acetylphenyl ester, 2-Acetylphenyl dimethylcarbamate, (2-acetylphenyl) N,N-dimethylcarbamate, 2 -(Dimethylcarbamoyloxy)acetophenone, 2-ACETYLPHENYL N,N-DIMETHYLCARBAMATE
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 29230-99-7 |
|---|---|
| SMILES | CC(=O)C1=CC=CC=C1OC(=O)N(C)C |
| InChIKey | LZYFTKRZIWILMC-UHFFFAOYSA-N |
Product Overview
Dimethylcarbamic acid 2-acetylphenyl ester (CAS 29230-99-7), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: (2-acetylphenyl) N,N-dimethylcarbamate.
Chemical Property Profile of Dimethylcarbamic acid 2-acetylphenyl ester
Property Insights of Dimethylcarbamic acid 2-acetylphenyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethylcarbamic acid 2-acetylphenyl ester. With a topological polar surface area (TPSA) of 46.6 Ų, Dimethylcarbamic acid 2-acetylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylcarbamic acid 2-acetylphenyl ester 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 Dimethylcarbamic acid 2-acetylphenyl ester?
The CAS number of Dimethylcarbamic acid 2-acetylphenyl ester is 29230-99-7.
What is the molecular formula of Dimethylcarbamic acid 2-acetylphenyl ester?
The molecular formula of Dimethylcarbamic acid 2-acetylphenyl ester is C11H13NO3.
What is the molecular weight of Dimethylcarbamic acid 2-acetylphenyl ester?
The molecular weight of Dimethylcarbamic acid 2-acetylphenyl ester is 207.09 g/mol.
Where can I buy Dimethylcarbamic acid 2-acetylphenyl ester?
You can request a quote for Dimethylcarbamic acid 2-acetylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethylcarbamic acid 2-acetylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Dimethylcarbamic acid 2-acetylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.