2,2-Dichloro-N-heptylethanimidic acid
TL;DR: 2,2-Dichloro-N-heptylethanimidic acid (CAS 63014-02-8) is a chemical compound with molecular formula C9H17Cl2NO and molecular weight 225.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-N-heptylacetamide
Also Known As: 2,2-dichloro-n-heptylacetamide, Dichloro-N-heptylethanimidic acid, 2,2-Dichloro-N-heptylethanimidic acid, N.N-Di-sek.-butyl-dichloracetamid
| Molecular Formula | C9H17Cl2NO |
|---|---|
| Molecular Weight | 225.07 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 225.06873 |
| Heavy Atoms | 13 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 63014-02-8 |
|---|---|
| SMILES | CCCCCCCNC(=O)C(Cl)Cl |
| InChIKey | OPOWREBDOCAJDQ-UHFFFAOYSA-N |
Product Overview
2,2-Dichloro-N-heptylethanimidic acid (CAS 63014-02-8), with molecular formula C9H17Cl2NO and molecular weight 225.07 g/mol. IUPAC: 2,2-dichloro-N-heptylacetamide.
Chemical Property Profile of 2,2-Dichloro-N-heptylethanimidic acid
Property Insights of 2,2-Dichloro-N-heptylethanimidic acid
The XLogP value of 3.8 indicates that 2,2-Dichloro-N-heptylethanimidic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2,2-Dichloro-N-heptylethanimidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dichloro-N-heptylethanimidic acid has 1 hydrogen bond donor(s) and 1 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 2,2-Dichloro-N-heptylethanimidic acid?
The CAS number of 2,2-Dichloro-N-heptylethanimidic acid is 63014-02-8.
What is the molecular formula of 2,2-Dichloro-N-heptylethanimidic acid?
The molecular formula of 2,2-Dichloro-N-heptylethanimidic acid is C9H17Cl2NO.
What is the molecular weight of 2,2-Dichloro-N-heptylethanimidic acid?
The molecular weight of 2,2-Dichloro-N-heptylethanimidic acid is 225.07 g/mol.
Where can I buy 2,2-Dichloro-N-heptylethanimidic acid?
You can request a quote for 2,2-Dichloro-N-heptylethanimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dichloro-N-heptylethanimidic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dichloro-N-heptylethanimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.