2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate
TL;DR: 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate (CAS 35858-25-4) is a chemical compound with molecular formula C12H14ClNO4 and molecular weight 271.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl carbamate
Also Known As: 5-19-02-00570 (Beilstein Handbook Reference), 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate, [2-(4-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl carbamate, 1,3-DIOXOLANE-4-METHANOL, 2-(p-CHLOROPHENYL)-2-METHYL-, CARBAMATE, [2-(4-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl aminooate
| Molecular Formula | C12H14ClNO4 |
|---|---|
| Molecular Weight | 271.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.06113 |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 35858-25-4 |
|---|---|
| SMILES | CC1(OCC(O1)COC(=O)N)C2=CC=C(C=C2)Cl |
| InChIKey | DDPXQCWRRXXQNQ-UHFFFAOYSA-N |
Product Overview
2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate (CAS 35858-25-4), with molecular formula C12H14ClNO4 and molecular weight 271.06 g/mol. IUPAC: [2-(4-chlorophenyl)-2-methyl-1,3-dioxolan-4-yl]methyl carbamate.
Chemical Property Profile of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate
Property Insights of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate. Following Lipinski's Rule of Five, 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate has 1 hydrogen bond donor(s) and 4 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 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate?
The CAS number of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate is 35858-25-4.
What is the molecular formula of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate?
The molecular formula of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate is C12H14ClNO4.
What is the molecular weight of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate?
The molecular weight of 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate is 271.06 g/mol.
Where can I buy 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate?
You can request a quote for 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-(p-Chlorophenyl)-2-methyl-1,3-dioxolane-4-methanol carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.