Propyl-d1-formate
TL;DR: Propyl-d1-formate (CAS 60703-00-6) is a chemical compound with molecular formula C4H8O2 and molecular weight 89.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl deuterioformate
Also Known As: Propyl-d1-formate, ISOPROPYL FORMATE, propan-2-yl deuterioformate, Propan-2-yl (~2~H)formate, Formic-d acid, 1-methylethyl ester
| Molecular Formula | C4H8O2 |
|---|---|
| Molecular Weight | 89.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 89.05871 |
| Heavy Atoms | 6 |
| Complexity | 40.0 |
Chemical Identifiers
| CAS Number | 60703-00-6 |
|---|---|
| SMILES | [2H]C(=O)OC(C)C |
| InChIKey | RMOUBSOVHSONPZ-WFVSFCRTSA-N |
Product Overview
Propyl-d1-formate (CAS 60703-00-6), with molecular formula C4H8O2 and molecular weight 89.06 g/mol. IUPAC: propan-2-yl deuterioformate.
Chemical Property Profile of Propyl-d1-formate
Property Insights of Propyl-d1-formate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl-d1-formate. With a topological polar surface area (TPSA) of 26.3 Ų, Propyl-d1-formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl-d1-formate has 0 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-d1-formate?
The CAS number of Propyl-d1-formate is 60703-00-6.
What is the molecular formula of Propyl-d1-formate?
The molecular formula of Propyl-d1-formate is C4H8O2.
What is the molecular weight of Propyl-d1-formate?
The molecular weight of Propyl-d1-formate is 89.06 g/mol.
Where can I buy Propyl-d1-formate?
You can request a quote for Propyl-d1-formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl-d1-formate?
Yes, KEHONG BIO provides custom synthesis services for Propyl-d1-formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.