Isopropyl (hydroxymethyl)-carbamate
TL;DR: Isopropyl (hydroxymethyl)-carbamate (CAS 14236-02-3) is a chemical compound with molecular formula C5H11NO3 and molecular weight 133.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(hydroxymethyl)carbamate
Also Known As: Isopropyl (hydroxymethyl)-carbamate, propan-2-yl N-(hydroxymethyl)carbamate, methylol isopropyl carbamate, isopropyl(hydroxymethyl)carbamate, Carbamic acid, (hydroxymethyl)-, 1-methylethyl ester
| Molecular Formula | C5H11NO3 |
|---|---|
| Molecular Weight | 133.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 133.0739 |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 14236-02-3 |
|---|---|
| SMILES | CC(C)OC(=O)NCO |
| InChIKey | DDAPWCYXRCDPQS-UHFFFAOYSA-N |
Product Overview
Isopropyl (hydroxymethyl)-carbamate (CAS 14236-02-3), with molecular formula C5H11NO3 and molecular weight 133.07 g/mol. IUPAC: propan-2-yl N-(hydroxymethyl)carbamate.
Chemical Property Profile of Isopropyl (hydroxymethyl)-carbamate
Property Insights of Isopropyl (hydroxymethyl)-carbamate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl (hydroxymethyl)-carbamate. With a topological polar surface area (TPSA) of 58.6 Ų, Isopropyl (hydroxymethyl)-carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl (hydroxymethyl)-carbamate 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
Frequently Asked Questions
What is the CAS number of Isopropyl (hydroxymethyl)-carbamate?
The CAS number of Isopropyl (hydroxymethyl)-carbamate is 14236-02-3.
What is the molecular formula of Isopropyl (hydroxymethyl)-carbamate?
The molecular formula of Isopropyl (hydroxymethyl)-carbamate is C5H11NO3.
What is the molecular weight of Isopropyl (hydroxymethyl)-carbamate?
The molecular weight of Isopropyl (hydroxymethyl)-carbamate is 133.07 g/mol.
Where can I buy Isopropyl (hydroxymethyl)-carbamate?
You can request a quote for Isopropyl (hydroxymethyl)-carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl (hydroxymethyl)-carbamate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl (hydroxymethyl)-carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.