3-环己烯-1-甲酰胺
TL;DR: 3-环己烯-1-甲酰胺 (CAS 79091-96-6) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-环己烯-1-甲酰胺
cyclohex-3-ene-1-carboxamide
Also Known As: cyclohex-3-ene-1-carboxamide, cyclohex-3-enecarboxamide, 3-Cyclohexene-1-carboxamide, (1R)-Cyclohex-3-ene-1-carboxamide, cyclohex-3-enecarboxylic acid amide
| Molecular Formula | C7H11NO |
|---|---|
| Molecular Weight | 125.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.08406 |
| Heavy Atoms | 9 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 79091-96-6 |
|---|---|
| SMILES | C1CC(CC=C1)C(=O)N |
| InChIKey | VSCLUBLXOWRBCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-环己烯-1-甲酰胺 (CAS 79091-96-6), with molecular formula C7H11NO and molecular weight 125.08 g/mol. IUPAC: cyclohex-3-ene-1-carboxamide.
Chemical Property Profile of 3-环己烯-1-甲酰胺
Property Insights of 3-环己烯-1-甲酰胺
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-环己烯-1-甲酰胺. With a topological polar surface area (TPSA) of 43.1 Ų, 3-环己烯-1-甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-环己烯-1-甲酰胺 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 3-环己烯-1-甲酰胺?
The CAS number of 3-环己烯-1-甲酰胺 is 79091-96-6.
What is the molecular formula of 3-环己烯-1-甲酰胺?
The molecular formula of 3-环己烯-1-甲酰胺 is C7H11NO.
What is the molecular weight of 3-环己烯-1-甲酰胺?
The molecular weight of 3-环己烯-1-甲酰胺 is 125.08 g/mol.
Where can I buy 3-环己烯-1-甲酰胺?
You can request a quote for 3-环己烯-1-甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-环己烯-1-甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 3-环己烯-1-甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.