1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-
TL;DR: 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- (CAS 38484-41-2) is a chemical compound with molecular formula C8H14O and molecular weight 126.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3,4,4-trimethylpent-1-yn-3-ol
Also Known As: (3S)-3,4,4-trimethylpent-1-yn-3-ol, pent-1-ynol-3 3,4,4-trimethyl, 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-, [S,(-)]-3,4,4-Trimethyl-1-pentyne-3-ol
| Molecular Formula | C8H14O |
|---|---|
| Molecular Weight | 126.10 g/mol |
| LogP | 1.4167 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 126.10446 |
| Heavy Atoms | 9 |
| Complexity | 131.62708 |
Chemical Identifiers
| CAS Number | 38484-41-2 |
|---|---|
| SMILES | C[C@@](C#C)(C(C)(C)C)O |
Product Overview
1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- (CAS 38484-41-2), with molecular formula C8H14O and molecular weight 126.10 g/mol. IUPAC: (3S)-3,4,4-trimethylpent-1-yn-3-ol.
Chemical Property Profile of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-
Property Insights of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-
The XLogP value of 1.4167 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-. With a topological polar surface area (TPSA) of 20.23 Ų, 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- 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 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-?
The CAS number of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- is 38484-41-2.
What is the molecular formula of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-?
The molecular formula of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- is C8H14O.
What is the molecular weight of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-?
The molecular weight of 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- is 126.10 g/mol.
Where can I buy 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-?
You can request a quote for 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pentyn-3-ol, 3,4,4-trimethyl-, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.