N-tert-butyl-4-chlorobutanamide
TL;DR: N-tert-butyl-4-chlorobutanamide (CAS 66003-33-6) is a chemical compound with molecular formula C8H16ClNO and molecular weight 177.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-4-chlorobutanamide
Also Known As: N-tert-butyl-4-chlorobutanamide, 4-chloro-N-tert-butyl-butanamide, 4-chloro-N-tert-butylbutyric amide, N-(TERT-BUTYL)-4-CHLOROBUTANAMIDE, 972-277-4
| Molecular Formula | C8H16ClNO |
|---|---|
| Molecular Weight | 177.09 g/mol |
| LogP | 1.9201 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.09204 |
| Heavy Atoms | 11 |
| Complexity | 128.54398 |
Chemical Identifiers
| CAS Number | 66003-33-6 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CCCCl |
Product Overview
N-tert-butyl-4-chlorobutanamide (CAS 66003-33-6), with molecular formula C8H16ClNO and molecular weight 177.09 g/mol. IUPAC: N-tert-butyl-4-chlorobutanamide.
Chemical Property Profile of N-tert-butyl-4-chlorobutanamide
Property Insights of N-tert-butyl-4-chlorobutanamide
The XLogP value of 1.9201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-tert-butyl-4-chlorobutanamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-tert-butyl-4-chlorobutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-tert-butyl-4-chlorobutanamide 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 N-tert-butyl-4-chlorobutanamide?
The CAS number of N-tert-butyl-4-chlorobutanamide is 66003-33-6.
What is the molecular formula of N-tert-butyl-4-chlorobutanamide?
The molecular formula of N-tert-butyl-4-chlorobutanamide is C8H16ClNO.
What is the molecular weight of N-tert-butyl-4-chlorobutanamide?
The molecular weight of N-tert-butyl-4-chlorobutanamide is 177.09 g/mol.
Where can I buy N-tert-butyl-4-chlorobutanamide?
You can request a quote for N-tert-butyl-4-chlorobutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-tert-butyl-4-chlorobutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-tert-butyl-4-chlorobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.