Butyric acid, 3-(benzylselenyl)-3-methyl-
TL;DR: Butyric acid, 3-(benzylselenyl)-3-methyl- (CAS 1599-29-7) is a chemical compound with molecular formula C12H16O2Se and molecular weight 272.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylselanyl-3-methylbutanoic acid
Also Known As: 3-benzylselanyl-3-methylbutanoic acid, Butyric acid, 3-(benzylselenyl)-3-methyl-, 3-(Benzylselanyl)-3-methylbutanoic acid, 3-(Benzylseleno)-3-methylbutyric acid, 3-(Benzylselanyl)-3-methylbutanoic acid #
| Molecular Formula | C12H16O2Se |
|---|---|
| Molecular Weight | 272.03 g/mol |
| LogP | 2.564 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.03156 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 1599-29-7 |
|---|---|
| SMILES | CC(C)(CC(=O)O)[Se]CC1=CC=CC=C1 |
| InChIKey | DUBZVANHXPGPCZ-UHFFFAOYSA-N |
Product Overview
Butyric acid, 3-(benzylselenyl)-3-methyl- (CAS 1599-29-7), with molecular formula C12H16O2Se and molecular weight 272.03 g/mol. IUPAC: 3-benzylselanyl-3-methylbutanoic acid.
Chemical Property Profile of Butyric acid, 3-(benzylselenyl)-3-methyl-
Property Insights of Butyric acid, 3-(benzylselenyl)-3-methyl-
The XLogP value of 2.564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyric acid, 3-(benzylselenyl)-3-methyl-. With a topological polar surface area (TPSA) of 37.3 Ų, Butyric acid, 3-(benzylselenyl)-3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyric acid, 3-(benzylselenyl)-3-methyl- 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, 3-(benzylselenyl)-3-methyl-?
The CAS number of Butyric acid, 3-(benzylselenyl)-3-methyl- is 1599-29-7.
What is the molecular formula of Butyric acid, 3-(benzylselenyl)-3-methyl-?
The molecular formula of Butyric acid, 3-(benzylselenyl)-3-methyl- is C12H16O2Se.
What is the molecular weight of Butyric acid, 3-(benzylselenyl)-3-methyl-?
The molecular weight of Butyric acid, 3-(benzylselenyl)-3-methyl- is 272.03 g/mol.
Where can I buy Butyric acid, 3-(benzylselenyl)-3-methyl-?
You can request a quote for Butyric acid, 3-(benzylselenyl)-3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyric acid, 3-(benzylselenyl)-3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Butyric acid, 3-(benzylselenyl)-3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.