2,3-二甲基-2-丁醇
TL;DR: 2,3-二甲基-2-丁醇 (CAS 594-60-5) is a chemical compound with molecular formula C6H14O and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-二甲基-2-丁醇
2,3-dimethylbutan-2-ol
Also Known As: 2,3-DIMETHYL-2-BUTANOL, 2,3-Dimethylbutan-2-ol, Thexyl alcohol, Isopropyldimethylcarbinol, 2-Butanol, 2,3-dimethyl-
| Molecular Formula | C6H14O |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 55.0 |
Chemical Identifiers
| CAS Number | 594-60-5 |
|---|---|
| SMILES | CC(C)C(C)(C)O |
| InChIKey | IKECULIHBUCAKR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-二甲基-2-丁醇 (CAS 594-60-5), with molecular formula C6H14O and molecular weight 102.10 g/mol. IUPAC: 2,3-dimethylbutan-2-ol.
Chemical Property Profile of 2,3-二甲基-2-丁醇
Property Insights of 2,3-二甲基-2-丁醇
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-二甲基-2-丁醇. With a topological polar surface area (TPSA) of 20.2 Ų, 2,3-二甲基-2-丁醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-二甲基-2-丁醇 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 2,3-二甲基-2-丁醇?
The CAS number of 2,3-二甲基-2-丁醇 is 594-60-5.
What is the molecular formula of 2,3-二甲基-2-丁醇?
The molecular formula of 2,3-二甲基-2-丁醇 is C6H14O.
What is the molecular weight of 2,3-二甲基-2-丁醇?
The molecular weight of 2,3-二甲基-2-丁醇 is 102.10 g/mol.
Where can I buy 2,3-二甲基-2-丁醇?
You can request a quote for 2,3-二甲基-2-丁醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-二甲基-2-丁醇?
Yes, KEHONG BIO provides custom synthesis services for 2,3-二甲基-2-丁醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.