Butyric acid, 2-tert-butyl-3,3-dimethyl-
TL;DR: Butyric acid, 2-tert-butyl-3,3-dimethyl- (CAS 41785-81-3) is a chemical compound with molecular formula C10H20O2 and molecular weight 172.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-3,3-dimethylbutanoic acid
Also Known As: 2-tert-butyl-3,3-dimethylbutanoic acid, Di-tert-Butylacetic acid, di-t-butylacetic acid, starbld0003481, Butyric acid, 2-tert-butyl-3,3-dimethyl-
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 41785-81-3 |
|---|---|
| SMILES | CC(C)(C)C(C(=O)O)C(C)(C)C |
| InChIKey | CSUSKPNFQZZRGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyric acid, 2-tert-butyl-3,3-dimethyl- (CAS 41785-81-3), with molecular formula C10H20O2 and molecular weight 172.15 g/mol. IUPAC: 2-tert-butyl-3,3-dimethylbutanoic acid.
Chemical Property Profile of Butyric acid, 2-tert-butyl-3,3-dimethyl-
Property Insights of Butyric acid, 2-tert-butyl-3,3-dimethyl-
The XLogP value of 3.2 indicates that Butyric acid, 2-tert-butyl-3,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Butyric acid, 2-tert-butyl-3,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 2-tert-butyl-3,3-dimethyl- has 1 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 Butyric acid, 2-tert-butyl-3,3-dimethyl-?
The CAS number of Butyric acid, 2-tert-butyl-3,3-dimethyl- is 41785-81-3.
What is the molecular formula of Butyric acid, 2-tert-butyl-3,3-dimethyl-?
The molecular formula of Butyric acid, 2-tert-butyl-3,3-dimethyl- is C10H20O2.
What is the molecular weight of Butyric acid, 2-tert-butyl-3,3-dimethyl-?
The molecular weight of Butyric acid, 2-tert-butyl-3,3-dimethyl- is 172.15 g/mol.
Where can I buy Butyric acid, 2-tert-butyl-3,3-dimethyl-?
You can request a quote for Butyric acid, 2-tert-butyl-3,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 2-tert-butyl-3,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 2-tert-butyl-3,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.