2-methylpropan-2-(2H)ol
TL;DR: 2-methylpropan-2-(2H)ol (CAS 3972-25-6) is a chemical compound with molecular formula C4H10O and molecular weight 75.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-deuteriooxy-2-methylpropane
Also Known As: 2-Methyl-2-propan(ol-d), 2-Methylpropan-2-(2H)ol, tert-Butanol-OD, Tert-butyl Alcohol-OD, tert-butan(ol-d)
| Molecular Formula | C4H10O |
|---|---|
| Molecular Weight | 75.08 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 75.079445 |
| Heavy Atoms | 5 |
| Complexity | 25.0 |
Chemical Identifiers
| CAS Number | 3972-25-6 |
|---|---|
| SMILES | [2H]OC(C)(C)C |
| InChIKey | DKGAVHZHDRPRBM-UICOGKGYSA-N |
Product Overview
2-methylpropan-2-(2H)ol (CAS 3972-25-6), with molecular formula C4H10O and molecular weight 75.08 g/mol. IUPAC: 2-deuteriooxy-2-methylpropane.
Chemical Property Profile of 2-methylpropan-2-(2H)ol
Property Insights of 2-methylpropan-2-(2H)ol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methylpropan-2-(2H)ol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-methylpropan-2-(2H)ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-methylpropan-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 2-methylpropan-2-(2H)ol?
The CAS number of 2-methylpropan-2-(2H)ol is 3972-25-6.
What is the molecular formula of 2-methylpropan-2-(2H)ol?
The molecular formula of 2-methylpropan-2-(2H)ol is C4H10O.
What is the molecular weight of 2-methylpropan-2-(2H)ol?
The molecular weight of 2-methylpropan-2-(2H)ol is 75.08 g/mol.
Where can I buy 2-methylpropan-2-(2H)ol?
You can request a quote for 2-methylpropan-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 2-methylpropan-2-(2H)ol?
Yes, KEHONG BIO provides custom synthesis services for 2-methylpropan-2-(2H)ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.