2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-
TL;DR: 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- (CAS 112980-85-5) is a chemical compound with molecular formula C7H16BNO and molecular weight 141.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylpropyl)-1,3,2-oxazaborinane
Also Known As: (CH2)3NHOB-C4H9-iso, 2-Isobutyl-1,3,2-oxaazaborinane, 2-(2-methylpropyl)-1,3,2-oxazaborinane, 2-Isobutyl-1,3,2-oxazaborinane #, 1,3,2-Oxaazaborinane, 2-isobutyl-
| Molecular Formula | C7H16BNO |
|---|---|
| Molecular Weight | 141.13 g/mol |
| LogP | 1.1405 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.13249 |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 112980-85-5 |
|---|---|
| SMILES | B1(NCCCO1)CC(C)C |
| InChIKey | RGLKPWUCKVLGSY-UHFFFAOYSA-N |
Product Overview
2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- (CAS 112980-85-5), with molecular formula C7H16BNO and molecular weight 141.13 g/mol. IUPAC: 2-(2-methylpropyl)-1,3,2-oxazaborinane.
Chemical Property Profile of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-
Property Insights of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-
The XLogP value of 1.1405 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-. With a topological polar surface area (TPSA) of 21.3 Ų, 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- 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 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-?
The CAS number of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- is 112980-85-5.
What is the molecular formula of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-?
The molecular formula of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- is C7H16BNO.
What is the molecular weight of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-?
The molecular weight of 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- is 141.13 g/mol.
Where can I buy 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-?
You can request a quote for 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1,3,2-Oxazaborine, tetrahydro-2-(2-methylpropyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.