Propyl carbamate
TL;DR: Propyl carbamate (CAS 627-12-3) is a chemical compound with molecular formula C4H9NO2 and molecular weight 103.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl carbamate
Also Known As: PROPYL CARBAMATE, n-Propyl carbamate, Propylcarbamate, Propyl urethane, N-PROPYLCARBAMATE
| Molecular Formula | C4H9NO2 |
|---|---|
| Molecular Weight | 103.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 103.06333 |
| Heavy Atoms | 7 |
| Complexity | 62.0 |
| Melting Point | 60 °C |
| Boiling Point | 196 °C |
| Solubility | SOL IN WATER, ETHANOL & DIETHYL ETHER |
| Vapor Pressure | 1 MM HG @ 52.4 °C |
Chemical Identifiers
| CAS Number | 627-12-3 |
|---|---|
| SMILES | CCCOC(=O)N |
| InChIKey | YNTOKMNHRPSGFU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propyl carbamate (CAS 627-12-3), with molecular formula C4H9NO2 and molecular weight 103.06 g/mol. IUPAC: propyl carbamate.
Chemical Property Profile of Propyl carbamate
Property Insights of Propyl carbamate
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl carbamate. With a topological polar surface area (TPSA) of 52.3 Ų, Propyl carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl carbamate 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 Propyl carbamate?
The CAS number of Propyl carbamate is 627-12-3.
What is the molecular formula of Propyl carbamate?
The molecular formula of Propyl carbamate is C4H9NO2.
What is the molecular weight of Propyl carbamate?
The molecular weight of Propyl carbamate is 103.06 g/mol.
Where can I buy Propyl carbamate?
You can request a quote for Propyl carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl carbamate?
Yes, KEHONG BIO provides custom synthesis services for Propyl carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.