(3e)-2-Methyl-3-(phenylimino)butan-2-ol
TL;DR: (3e)-2-Methyl-3-(phenylimino)butan-2-ol (CAS 544-73-0) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-phenyliminobutan-2-ol
Also Known As: 2-methyl-3-phenyliminobutan-2-ol, (3e)-2-methyl-3-(phenylimino)butan-2-ol, KST-1A5804, 2-Butanol,2-methyl-3-(phenylimino)-, 3-hydroxy-3-methyl-butan-2-one-phenylimine
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 32.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 544-73-0 |
|---|---|
| SMILES | CC(=NC1=CC=CC=C1)C(C)(C)O |
| InChIKey | NVQJITVPOMHQSF-UHFFFAOYSA-N |
Product Overview
(3e)-2-Methyl-3-(phenylimino)butan-2-ol (CAS 544-73-0), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: 2-methyl-3-phenyliminobutan-2-ol.
Chemical Property Profile of (3e)-2-Methyl-3-(phenylimino)butan-2-ol
Property Insights of (3e)-2-Methyl-3-(phenylimino)butan-2-ol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3e)-2-Methyl-3-(phenylimino)butan-2-ol. With a topological polar surface area (TPSA) of 32.6 Ų, (3e)-2-Methyl-3-(phenylimino)butan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3e)-2-Methyl-3-(phenylimino)butan-2-ol 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 (3e)-2-Methyl-3-(phenylimino)butan-2-ol?
The CAS number of (3e)-2-Methyl-3-(phenylimino)butan-2-ol is 544-73-0.
What is the molecular formula of (3e)-2-Methyl-3-(phenylimino)butan-2-ol?
The molecular formula of (3e)-2-Methyl-3-(phenylimino)butan-2-ol is C11H15NO.
What is the molecular weight of (3e)-2-Methyl-3-(phenylimino)butan-2-ol?
The molecular weight of (3e)-2-Methyl-3-(phenylimino)butan-2-ol is 177.12 g/mol.
Where can I buy (3e)-2-Methyl-3-(phenylimino)butan-2-ol?
You can request a quote for (3e)-2-Methyl-3-(phenylimino)butan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3e)-2-Methyl-3-(phenylimino)butan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for (3e)-2-Methyl-3-(phenylimino)butan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.