methyl N-(2-bromo-4-methylphenyl)carbamate
TL;DR: methyl N-(2-bromo-4-methylphenyl)carbamate (CAS 540797-44-2) is a chemical compound with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(2-bromo-4-methylphenyl)carbamate
Also Known As: methyl N-(2-bromo-4-methylphenyl)carbamate, methyl (2-bromo-4-methylphenyl)carbamate, methylN-(2-bromo-4-methylphenyl)carbamate, N-(2-bromo-4-methylphenyl)methoxycarboxamide, (2-bromo-4-methylphenyl)carbamic acid methyl ester
| Molecular Formula | C9H10BrNO2 |
|---|---|
| Molecular Weight | 242.99 g/mol |
| LogP | 2.93582 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 242.98949 |
| Heavy Atoms | 13 |
| Complexity | 325.39078 |
Chemical Identifiers
| CAS Number | 540797-44-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)OC)Br |
Product Overview
methyl N-(2-bromo-4-methylphenyl)carbamate (CAS 540797-44-2), with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol. IUPAC: methyl N-(2-bromo-4-methylphenyl)carbamate.
Chemical Property Profile of methyl N-(2-bromo-4-methylphenyl)carbamate
Property Insights of methyl N-(2-bromo-4-methylphenyl)carbamate
The XLogP value of 2.93582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(2-bromo-4-methylphenyl)carbamate. With a topological polar surface area (TPSA) of 38.33 Ų, methyl N-(2-bromo-4-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-(2-bromo-4-methylphenyl)carbamate has 1 hydrogen bond donor(s) and 2 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-bromo-4-methylphenyl)carbamate?
The CAS number of methyl N-(2-bromo-4-methylphenyl)carbamate is 540797-44-2.
What is the molecular formula of methyl N-(2-bromo-4-methylphenyl)carbamate?
The molecular formula of methyl N-(2-bromo-4-methylphenyl)carbamate is C9H10BrNO2.
What is the molecular weight of methyl N-(2-bromo-4-methylphenyl)carbamate?
The molecular weight of methyl N-(2-bromo-4-methylphenyl)carbamate is 242.99 g/mol.
Where can I buy methyl N-(2-bromo-4-methylphenyl)carbamate?
You can request a quote for methyl N-(2-bromo-4-methylphenyl)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-bromo-4-methylphenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(2-bromo-4-methylphenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.