2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate
TL;DR: 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate (CAS 91340-01-1) is a chemical compound with molecular formula C11H17NO2 and molecular weight 195.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-prop-2-ynylcycloheptyl) carbamate
Also Known As: (2-prop-2-ynylcycloheptyl) carbamate, 1-(2-Propynyl)cycloheptanol carbamate, 1-(2-Propynyl)cycloheptyl ester of carbamic acid, Cycloheptanol, 1-(2-propynyl)-, carbamate, 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate
Technical Specifications
| Molecular Formula | C11H17NO2 |
| Molecular Weight | 195.12593 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.12593 Da |
| Heavy Atoms | 14 |
| Complexity | 241.0 |
| SMILES | C#CCC1CCCCCC1OC(=O)N |
| InChIKey | TVICDZNAJKDBNJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate
Property Insights of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate. With a topological polar surface area (TPSA) of 52.3 Ų, 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate 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
What is the CAS number of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate?
The CAS number of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate is 91340-01-1.
What is the molecular formula of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate?
The molecular formula of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate is C11H17NO2.
What is the molecular weight of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate?
The molecular weight of 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate is 195.12593 g/mol.
Where can I buy 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate?
You can request a quote for 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate?
Yes, CoreyChem provides custom synthesis services for 2-(Prop-2-yn-1-yl)cycloheptyl hydrogen carbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.