5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride
TL;DR: 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride (CAS 100156-25-0) is a chemical compound with molecular formula C8H16ClNO and molecular weight 177.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-2-methylpent-3-yn-2-ol;hydrochloride
Also Known As: 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride, 5-(dimethylamino)-2-methylpent-3-yn-2-ol,hydrochloride, 5-dimethylamino-2-methyl-pent-3-yn-2-ol Hydrochloride, 5-(Dimethylamino)-2-methylpent-3-yn-2-ol--hydrogen chloride (1/1)
| Molecular Formula | C8H16ClNO |
|---|---|
| Molecular Weight | 177.09 g/mol |
| LogP | 0.7441 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.09204 |
| Heavy Atoms | 11 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 100156-25-0 |
|---|---|
| SMILES | CC(C)(C#CCN(C)C)O.Cl |
| InChIKey | YWCJXCPTDNUUET-UHFFFAOYSA-N |
Product Overview
5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride (CAS 100156-25-0), with molecular formula C8H16ClNO and molecular weight 177.09 g/mol. IUPAC: 5-(dimethylamino)-2-methylpent-3-yn-2-ol;hydrochloride.
Chemical Property Profile of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride
Property Insights of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride
The XLogP value of 0.7441 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride. With a topological polar surface area (TPSA) of 23.5 Ų, 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride has 2 hydrogen bond donor(s) and 2 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 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride?
The CAS number of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride is 100156-25-0.
What is the molecular formula of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride?
The molecular formula of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride is C8H16ClNO.
What is the molecular weight of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride?
The molecular weight of 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride is 177.09 g/mol.
Where can I buy 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride?
You can request a quote for 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-2-methylpent-3-yn-2-ol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.