![Propan-2-[2H]ol structure](/static/products/3979/3979-51-9.webp)
Propan-2-[2H]ol
TL;DR: Propan-2-[2H]ol (CAS 3979-51-9) is a chemical compound with molecular formula C3H8O and molecular weight 61.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-deuteriooxypropane
Also Known As: 2-deuteriooxypropane, 2-Propan(ol-d), Isopropanol-d, Propan-2-(2H)ol, isopropanol
| Molecular Formula | C3H8O |
|---|---|
| Molecular Weight | 61.06 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 61.063793 |
| Heavy Atoms | 4 |
| Complexity | 10.0 |
Chemical Identifiers
| CAS Number | 3979-51-9 |
|---|---|
| SMILES | [2H]OC(C)C |
| InChIKey | KFZMGEQAYNKOFK-QYKNYGDISA-N |
Product Overview
Propan-2-[2H]ol (CAS 3979-51-9), with molecular formula C3H8O and molecular weight 61.06 g/mol. IUPAC: 2-deuteriooxypropane.
Chemical Property Profile of Propan-2-[2H]ol
Property Insights of Propan-2-[2H]ol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propan-2-[2H]ol. With a topological polar surface area (TPSA) of 20.2 Ų, Propan-2-[2H]ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-[2H]ol has 1 hydrogen bond donor(s) and 1 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 Propan-2-[2H]ol?
The CAS number of Propan-2-[2H]ol is 3979-51-9.
What is the molecular formula of Propan-2-[2H]ol?
The molecular formula of Propan-2-[2H]ol is C3H8O.
What is the molecular weight of Propan-2-[2H]ol?
The molecular weight of Propan-2-[2H]ol is 61.06 g/mol.
Where can I buy Propan-2-[2H]ol?
You can request a quote for Propan-2-[2H]ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-[2H]ol?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-[2H]ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.