(1-甲基乙基)氨基甲酸苯酯
TL;DR: (1-甲基乙基)氨基甲酸苯酯 (CAS 17614-10-7) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-甲基乙基)氨基甲酸苯酯
phenyl N-propan-2-ylcarbamate
Also Known As: phenyl N-isopropylcarbamate, Phenyl Isopropylcarbamate, phenyl N-(propan-2-yl)carbamate, (1-Methylethyl)carbamic Acid Phenyl Ester, phenyl N-propan-2-ylcarbamate
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 17614-10-7 |
|---|---|
| SMILES | CC(C)NC(=O)OC1=CC=CC=C1 |
| InChIKey | RJUVFGTVVVYSFK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1-甲基乙基)氨基甲酸苯酯 (CAS 17614-10-7), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: phenyl N-propan-2-ylcarbamate.
Chemical Property Profile of (1-甲基乙基)氨基甲酸苯酯
Property Insights of (1-甲基乙基)氨基甲酸苯酯
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-甲基乙基)氨基甲酸苯酯. With a topological polar surface area (TPSA) of 38.3 Ų, (1-甲基乙基)氨基甲酸苯酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-甲基乙基)氨基甲酸苯酯 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 (1-甲基乙基)氨基甲酸苯酯?
The CAS number of (1-甲基乙基)氨基甲酸苯酯 is 17614-10-7.
What is the molecular formula of (1-甲基乙基)氨基甲酸苯酯?
The molecular formula of (1-甲基乙基)氨基甲酸苯酯 is C10H13NO2.
What is the molecular weight of (1-甲基乙基)氨基甲酸苯酯?
The molecular weight of (1-甲基乙基)氨基甲酸苯酯 is 179.09 g/mol.
Where can I buy (1-甲基乙基)氨基甲酸苯酯?
You can request a quote for (1-甲基乙基)氨基甲酸苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-甲基乙基)氨基甲酸苯酯?
Yes, KEHONG BIO provides custom synthesis services for (1-甲基乙基)氨基甲酸苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.