2-chloro-N-(oxolan-2-ylmethyl)propanamide
TL;DR: 2-chloro-N-(oxolan-2-ylmethyl)propanamide (CAS 596807-96-4) is a chemical compound with molecular formula C8H14ClNO2 and molecular weight 191.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(oxolan-2-ylmethyl)propanamide
Also Known As: 2-chloro-N-(oxolan-2-ylmethyl)propanamide, 2-chloro-N-[(oxolan-2-yl)methyl]propanamide, Propanamide, N-tetrahydrofurfuryl-2-chloro-, 2-Chloro-N-((tetrahydrofuran-2-yl)methyl)propanamide, J1.953.470G
| Molecular Formula | C8H14ClNO2 |
|---|---|
| Molecular Weight | 191.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.0713 |
| Heavy Atoms | 12 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 596807-96-4 |
|---|---|
| SMILES | CC(C(=O)NCC1CCCO1)Cl |
| InChIKey | CCYFCLVMSOMMEF-UHFFFAOYSA-N |
Product Overview
2-chloro-N-(oxolan-2-ylmethyl)propanamide (CAS 596807-96-4), with molecular formula C8H14ClNO2 and molecular weight 191.07 g/mol. IUPAC: 2-chloro-N-(oxolan-2-ylmethyl)propanamide.
Chemical Property Profile of 2-chloro-N-(oxolan-2-ylmethyl)propanamide
Property Insights of 2-chloro-N-(oxolan-2-ylmethyl)propanamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(oxolan-2-ylmethyl)propanamide. With a topological polar surface area (TPSA) of 38.3 Ų, 2-chloro-N-(oxolan-2-ylmethyl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(oxolan-2-ylmethyl)propanamide 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-chloro-N-(oxolan-2-ylmethyl)propanamide?
The CAS number of 2-chloro-N-(oxolan-2-ylmethyl)propanamide is 596807-96-4.
What is the molecular formula of 2-chloro-N-(oxolan-2-ylmethyl)propanamide?
The molecular formula of 2-chloro-N-(oxolan-2-ylmethyl)propanamide is C8H14ClNO2.
What is the molecular weight of 2-chloro-N-(oxolan-2-ylmethyl)propanamide?
The molecular weight of 2-chloro-N-(oxolan-2-ylmethyl)propanamide is 191.07 g/mol.
Where can I buy 2-chloro-N-(oxolan-2-ylmethyl)propanamide?
You can request a quote for 2-chloro-N-(oxolan-2-ylmethyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(oxolan-2-ylmethyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(oxolan-2-ylmethyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.