2-Propyn-1-ol, 3-chloro-1-cyclohexyl-
TL;DR: 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- (CAS 101166-80-7) is a chemical compound with molecular formula C9H13ClO and molecular weight 172.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-cyclohexylprop-2-yn-1-ol
Also Known As: 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-, 3-chloro-1-cyclohexylprop-2-yn-1-ol, Cyclohexanemethanol, alpha-(2-chloroethynyl)-, 3-Chloro-1-cyclohexyl-2-propyn-1-ol, RefChem:1064607
| Molecular Formula | C9H13ClO |
|---|---|
| Molecular Weight | 172.07 g/mol |
| LogP | 2.1273 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.06549 |
| Heavy Atoms | 11 |
| Complexity | 162.13689 |
Chemical Identifiers
| CAS Number | 101166-80-7 |
|---|---|
| SMILES | C1CCC(CC1)C(C#CCl)O |
Product Overview
2-Propyn-1-ol, 3-chloro-1-cyclohexyl- (CAS 101166-80-7), with molecular formula C9H13ClO and molecular weight 172.07 g/mol. IUPAC: 3-chloro-1-cyclohexylprop-2-yn-1-ol.
Chemical Property Profile of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-
Property Insights of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-
The XLogP value of 2.1273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-. With a topological polar surface area (TPSA) of 20.23 Ų, 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- 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-Propyn-1-ol, 3-chloro-1-cyclohexyl-?
The CAS number of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- is 101166-80-7.
What is the molecular formula of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-?
The molecular formula of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- is C9H13ClO.
What is the molecular weight of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-?
The molecular weight of 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- is 172.07 g/mol.
Where can I buy 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-?
You can request a quote for 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propyn-1-ol, 3-chloro-1-cyclohexyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propyn-1-ol, 3-chloro-1-cyclohexyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.