1-Butyne, 3,3-dimethyl-1-phosphinyl-
TL;DR: 1-Butyne, 3,3-dimethyl-1-phosphinyl- (CAS 77376-07-9) is a chemical compound with molecular formula C6H11P and molecular weight 114.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethylbut-1-ynylphosphane
Also Known As: (CH3)3CC.equiv.CPH2, 1-Butyne, 3,3-dimethyl-1-phosphinyl-, 3,3-dimethylbut-1-ynylphosphane, (3,3-dimethylbut-1-yn-1-yl)phosphine, (3,3-DIMETHYLBUT-1-YN-1-YL)PHOSPHANE
| Molecular Formula | C6H11P |
|---|---|
| Molecular Weight | 114.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.05984 |
| Heavy Atoms | 7 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 77376-07-9 |
|---|---|
| SMILES | CC(C)(C)C#CP |
| InChIKey | DQQSYGFDYIXRAW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butyne, 3,3-dimethyl-1-phosphinyl- (CAS 77376-07-9), with molecular formula C6H11P and molecular weight 114.06 g/mol. IUPAC: 3,3-dimethylbut-1-ynylphosphane.
Chemical Property Profile of 1-Butyne, 3,3-dimethyl-1-phosphinyl-
Property Insights of 1-Butyne, 3,3-dimethyl-1-phosphinyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyne, 3,3-dimethyl-1-phosphinyl-. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Butyne, 3,3-dimethyl-1-phosphinyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyne, 3,3-dimethyl-1-phosphinyl- has 0 hydrogen bond donor(s) and 0 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 1-Butyne, 3,3-dimethyl-1-phosphinyl-?
The CAS number of 1-Butyne, 3,3-dimethyl-1-phosphinyl- is 77376-07-9.
What is the molecular formula of 1-Butyne, 3,3-dimethyl-1-phosphinyl-?
The molecular formula of 1-Butyne, 3,3-dimethyl-1-phosphinyl- is C6H11P.
What is the molecular weight of 1-Butyne, 3,3-dimethyl-1-phosphinyl-?
The molecular weight of 1-Butyne, 3,3-dimethyl-1-phosphinyl- is 114.06 g/mol.
Where can I buy 1-Butyne, 3,3-dimethyl-1-phosphinyl-?
You can request a quote for 1-Butyne, 3,3-dimethyl-1-phosphinyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyne, 3,3-dimethyl-1-phosphinyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyne, 3,3-dimethyl-1-phosphinyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.