Carbonic acid, methyl 4-methylphenyl ester
TL;DR: Carbonic acid, methyl 4-methylphenyl ester (CAS 1848-01-7) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (4-methylphenyl) carbonate
Also Known As: Methyl p-tolyl carbonate, Methyl 4-methylphenyl carbonate, methyl (4-methylphenyl) carbonate, Carbonic acid, methyl 4-methylphenyl ester, Carbonic acid, methyl p-tolyl ester
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 1848-01-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC(=O)OC |
| InChIKey | FLSOKBQNISCLMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbonic acid, methyl 4-methylphenyl ester (CAS 1848-01-7), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: methyl (4-methylphenyl) carbonate.
Chemical Property Profile of Carbonic acid, methyl 4-methylphenyl ester
Property Insights of Carbonic acid, methyl 4-methylphenyl ester
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbonic acid, methyl 4-methylphenyl ester. With a topological polar surface area (TPSA) of 35.5 Ų, Carbonic acid, methyl 4-methylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonic acid, methyl 4-methylphenyl 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 Carbonic acid, methyl 4-methylphenyl ester?
The CAS number of Carbonic acid, methyl 4-methylphenyl ester is 1848-01-7.
What is the molecular formula of Carbonic acid, methyl 4-methylphenyl ester?
The molecular formula of Carbonic acid, methyl 4-methylphenyl ester is C9H10O3.
What is the molecular weight of Carbonic acid, methyl 4-methylphenyl ester?
The molecular weight of Carbonic acid, methyl 4-methylphenyl ester is 166.06 g/mol.
Where can I buy Carbonic acid, methyl 4-methylphenyl ester?
You can request a quote for Carbonic acid, methyl 4-methylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, methyl 4-methylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, methyl 4-methylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.