Carbamic acid, 4-methoxyphenyl-, isobutyl ester
TL;DR: Carbamic acid, 4-methoxyphenyl-, isobutyl ester (CAS 91644-89-2) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylpropyl N-(4-methoxyphenyl)carbamate
Also Known As: 2-methylpropyl N-(4-methoxyphenyl)carbamate, 4-Methoxyphenylcarbamic acid isobutyl ester, Carbamic acid, 4-methoxyphenyl-, isobutyl ester, J2.082.616I, Carbamic acid, (4-methoxyphenyl)-, 2-methylpropyl ester
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 2.8997 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 332.62204 |
Chemical Identifiers
| CAS Number | 91644-89-2 |
|---|---|
| SMILES | CC(C)COC(=O)NC1=CC=C(C=C1)OC |
Product Overview
Carbamic acid, 4-methoxyphenyl-, isobutyl ester (CAS 91644-89-2), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: 2-methylpropyl N-(4-methoxyphenyl)carbamate.
Chemical Property Profile of Carbamic acid, 4-methoxyphenyl-, isobutyl ester
Property Insights of Carbamic acid, 4-methoxyphenyl-, isobutyl ester
The XLogP value of 2.8997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, 4-methoxyphenyl-, isobutyl ester. With a topological polar surface area (TPSA) of 47.56 Ų, Carbamic acid, 4-methoxyphenyl-, isobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, 4-methoxyphenyl-, isobutyl ester has 1 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 Carbamic acid, 4-methoxyphenyl-, isobutyl ester?
The CAS number of Carbamic acid, 4-methoxyphenyl-, isobutyl ester is 91644-89-2.
What is the molecular formula of Carbamic acid, 4-methoxyphenyl-, isobutyl ester?
The molecular formula of Carbamic acid, 4-methoxyphenyl-, isobutyl ester is C12H17NO3.
What is the molecular weight of Carbamic acid, 4-methoxyphenyl-, isobutyl ester?
The molecular weight of Carbamic acid, 4-methoxyphenyl-, isobutyl ester is 223.12 g/mol.
Where can I buy Carbamic acid, 4-methoxyphenyl-, isobutyl ester?
You can request a quote for Carbamic acid, 4-methoxyphenyl-, isobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, 4-methoxyphenyl-, isobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, 4-methoxyphenyl-, isobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.