4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline
TL;DR: 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline (CAS 306979-56-6) is a chemical compound with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline
Also Known As: 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline, 12K-022, N-(4-chlorophenyl)-N-(2,2-dimethoxy-1,1-dimethylethyl)amine
| Molecular Formula | C12H18ClNO2 |
|---|---|
| Molecular Weight | 243.10 g/mol |
| LogP | 3.1494 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.1026 |
| Heavy Atoms | 16 |
| Complexity | 320.29556 |
Chemical Identifiers
| CAS Number | 306979-56-6 |
|---|---|
| SMILES | CC(C)(C(OC)OC)NC1=CC=C(C=C1)Cl |
Product Overview
4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline (CAS 306979-56-6), with molecular formula C12H18ClNO2 and molecular weight 243.10 g/mol. IUPAC: 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline.
Chemical Property Profile of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline
Property Insights of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline
The XLogP value of 3.1494 indicates that 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline has 1 hydrogen bond donor(s) and 3 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 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline?
The CAS number of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline is 306979-56-6.
What is the molecular formula of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline?
The molecular formula of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline is C12H18ClNO2.
What is the molecular weight of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline?
The molecular weight of 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline is 243.10 g/mol.
Where can I buy 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline?
You can request a quote for 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-(1,1-dimethoxy-2-methylpropan-2-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.