3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate
TL;DR: 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate (CAS 34409-15-9) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(hydroxymethyl)-4,5-dimethylphenyl] N-methylcarbamate
Also Known As: 3-(hydroxymethyl)-4,5-dimethylphenyl methylcarbamate, N.N'-Bis-<3-hydroxy-propyl>-piperazin, [3-(hydroxymethyl)-4,5-dimethylphenyl] N-methylcarbamate, [3-(hydroxymethyl)-4,5-dimethyl-phenyl] N-methylcarbamate, Carbamic acid, methyl-, 3-(hydroxymethyl)-4,5-dimethylphenyl ester
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 34409-15-9 |
|---|---|
| SMILES | CC1=CC(=CC(=C1C)CO)OC(=O)NC |
| InChIKey | OJZPBXBTYARNJO-UHFFFAOYSA-N |
Product Overview
3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate (CAS 34409-15-9), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: [3-(hydroxymethyl)-4,5-dimethylphenyl] N-methylcarbamate.
Chemical Property Profile of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate
Property Insights of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate. With a topological polar surface area (TPSA) of 58.6 Ų, 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate has 2 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 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate?
The CAS number of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate is 34409-15-9.
What is the molecular formula of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate?
The molecular formula of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate is C11H15NO3.
What is the molecular weight of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate?
The molecular weight of 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate is 209.11 g/mol.
Where can I buy 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate?
You can request a quote for 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Hydroxymethyl)-4,5-dimethylphenyl methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.