3-Penten-1-yne, 3-methyl-
TL;DR: 3-Penten-1-yne, 3-methyl- (CAS 14272-80-1) is a chemical compound with molecular formula C6H8 and molecular weight 80.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-methylpent-3-en-1-yne
Also Known As: 3-Methylpent-3-en-1-yne, 3-Penten-1-yne, 3-methyl-, 3-Methyl-3-penten-1-yne, (E)-3-methylpent-3-en-1-yne, 3-Methyl-2-penten-4-yne
| Molecular Formula | C6H8 |
|---|---|
| Molecular Weight | 80.06 g/mol |
| LogP | 1.5858 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 80.0626 |
| Heavy Atoms | 6 |
| Complexity | 91.09616 |
Chemical Identifiers
| CAS Number | 14272-80-1 |
|---|---|
| SMILES | C/C=C(\C)/C#C |
Product Overview
3-Penten-1-yne, 3-methyl- (CAS 14272-80-1), with molecular formula C6H8 and molecular weight 80.06 g/mol. IUPAC: (E)-3-methylpent-3-en-1-yne.
Chemical Property Profile of 3-Penten-1-yne, 3-methyl-
Property Insights of 3-Penten-1-yne, 3-methyl-
The XLogP value of 1.5858 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Penten-1-yne, 3-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Penten-1-yne, 3-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Penten-1-yne, 3-methyl- 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 3-Penten-1-yne, 3-methyl-?
The CAS number of 3-Penten-1-yne, 3-methyl- is 14272-80-1.
What is the molecular formula of 3-Penten-1-yne, 3-methyl-?
The molecular formula of 3-Penten-1-yne, 3-methyl- is C6H8.
What is the molecular weight of 3-Penten-1-yne, 3-methyl-?
The molecular weight of 3-Penten-1-yne, 3-methyl- is 80.06 g/mol.
Where can I buy 3-Penten-1-yne, 3-methyl-?
You can request a quote for 3-Penten-1-yne, 3-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Penten-1-yne, 3-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Penten-1-yne, 3-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.