甲基N-(3-氯苯基)氨基甲酸酯
TL;DR: 甲基N-(3-氯苯基)氨基甲酸酯 (CAS 2150-88-1) is a chemical compound with molecular formula C8H8ClNO2 and molecular weight 185.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基N-(3-氯苯基)氨基甲酸酯
methyl N-(3-chlorophenyl)carbamate
Also Known As: Methyl (3-chlorophenyl)carbamate, METHYL N-(3-CHLOROPHENYL)CARBAMATE, methyl 3-chlorophenylcarbamate, methyl-N-(3-chlorophenyl)carbamate, N-(3-chlorophenyl)methoxycarboxamide
| Molecular Formula | C8H8ClNO2 |
|---|---|
| Molecular Weight | 185.02 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.02435 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 2150-88-1 |
|---|---|
| SMILES | COC(=O)NC1=CC(=CC=C1)Cl |
| InChIKey | SEPMCAVKHUPSMA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基N-(3-氯苯基)氨基甲酸酯 (CAS 2150-88-1), with molecular formula C8H8ClNO2 and molecular weight 185.02 g/mol. IUPAC: methyl N-(3-chlorophenyl)carbamate.
Chemical Property Profile of 甲基N-(3-氯苯基)氨基甲酸酯
Property Insights of 甲基N-(3-氯苯基)氨基甲酸酯
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基N-(3-氯苯基)氨基甲酸酯. With a topological polar surface area (TPSA) of 38.3 Ų, 甲基N-(3-氯苯基)氨基甲酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基N-(3-氯苯基)氨基甲酸酯 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 甲基N-(3-氯苯基)氨基甲酸酯?
The CAS number of 甲基N-(3-氯苯基)氨基甲酸酯 is 2150-88-1.
What is the molecular formula of 甲基N-(3-氯苯基)氨基甲酸酯?
The molecular formula of 甲基N-(3-氯苯基)氨基甲酸酯 is C8H8ClNO2.
What is the molecular weight of 甲基N-(3-氯苯基)氨基甲酸酯?
The molecular weight of 甲基N-(3-氯苯基)氨基甲酸酯 is 185.02 g/mol.
Where can I buy 甲基N-(3-氯苯基)氨基甲酸酯?
You can request a quote for 甲基N-(3-氯苯基)氨基甲酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基N-(3-氯苯基)氨基甲酸酯?
Yes, KEHONG BIO provides custom synthesis services for 甲基N-(3-氯苯基)氨基甲酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.