1,2-Propanediol, monocarbamate
TL;DR: 1,2-Propanediol, monocarbamate (CAS 145639-05-0) is a chemical compound with molecular formula C4H9NO3 and molecular weight 119.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxypropyl carbamate
Also Known As: 2-hydroxypropyl carbamate, 2-Hydroxypropylcarbamate, 1, 1-carbamate, Hydroxypropyl carbamate, 1,2-Propanediol, 1-carbamate
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H9NO3 |
| Molecular Weight | 119.05824 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 119.05824 Da |
| Heavy Atoms | 8 |
| Complexity | 83.0 |
| SMILES | CC(COC(=O)N)O |
| InChIKey | YCDWNZGUODQFGU-UHFFFAOYSA-N |
Chemical Property Profile of 1,2-Propanediol, monocarbamate
Property Insights of 1,2-Propanediol, monocarbamate
The XLogP value of -0.8 indicates that 1,2-Propanediol, monocarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Propanediol, monocarbamate. Following Lipinski's Rule of Five, 1,2-Propanediol, monocarbamate has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,2-Propanediol, monocarbamate?
The CAS number of 1,2-Propanediol, monocarbamate is 145639-05-0.
What is the molecular formula of 1,2-Propanediol, monocarbamate?
The molecular formula of 1,2-Propanediol, monocarbamate is C4H9NO3.
What is the molecular weight of 1,2-Propanediol, monocarbamate?
The molecular weight of 1,2-Propanediol, monocarbamate is 119.05824 g/mol.
Where can I buy 1,2-Propanediol, monocarbamate?
You can request a quote for 1,2-Propanediol, monocarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,2-Propanediol, monocarbamate?
Yes, CoreyChem provides custom synthesis services for 1,2-Propanediol, monocarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.