2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-
TL;DR: 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- (CAS 189809-57-2) is a chemical compound with molecular formula C13H21NO and molecular weight 207.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyl-1-(N-methylanilino)butan-2-ol
Also Known As: 4-Pentynenitrile,3-ethyl-5-phenyl, 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-, 3,3-dimethyl-1-(N-methylanilino)butan-2-ol, 1-(Methylphenylamino)-3,3-dimethyl-2-butanol, 3,3-dimethyl-1-(methyl-phenyl-amino)butan-2-ol
| Molecular Formula | C13H21NO |
|---|---|
| Molecular Weight | 207.16 g/mol |
| LogP | 2.5298 |
| Topological Polar Surface Area | 23.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.16231 |
| Heavy Atoms | 15 |
| Complexity | 289.1543 |
Chemical Identifiers
| CAS Number | 189809-57-2 |
|---|---|
| SMILES | CC(C)(C)C(CN(C)C1=CC=CC=C1)O |
Product Overview
2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- (CAS 189809-57-2), with molecular formula C13H21NO and molecular weight 207.16 g/mol. IUPAC: 3,3-dimethyl-1-(N-methylanilino)butan-2-ol.
Chemical Property Profile of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-
Property Insights of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-
The XLogP value of 2.5298 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-. With a topological polar surface area (TPSA) of 23.47 Ų, 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- 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 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-?
The CAS number of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- is 189809-57-2.
What is the molecular formula of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-?
The molecular formula of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- is C13H21NO.
What is the molecular weight of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-?
The molecular weight of 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- is 207.16 g/mol.
Where can I buy 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-?
You can request a quote for 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanol, 3,3-dimethyl-1-(methylphenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.