3-Buten-2-ol, 1-(propylamino)-
TL;DR: 3-Buten-2-ol, 1-(propylamino)- (CAS 85771-10-4) is a chemical compound with molecular formula C7H15NO and molecular weight 129.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(propylamino)but-3-en-2-ol
Also Known As: 3-Buten-2-ol, 1-(propylamino)-, 1-(propylamino)but-3-en-2-ol
| Molecular Formula | C7H15NO |
|---|---|
| Molecular Weight | 129.12 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 129.11537 |
| Heavy Atoms | 9 |
| Complexity | 73.0 |
Chemical Identifiers
| CAS Number | 85771-10-4 |
|---|---|
| SMILES | CCCNCC(C=C)O |
| InChIKey | QDHFAWDLQLVTOC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Buten-2-ol, 1-(propylamino)- (CAS 85771-10-4), with molecular formula C7H15NO and molecular weight 129.12 g/mol. IUPAC: 1-(propylamino)but-3-en-2-ol.
Chemical Property Profile of 3-Buten-2-ol, 1-(propylamino)-
Property Insights of 3-Buten-2-ol, 1-(propylamino)-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Buten-2-ol, 1-(propylamino)-. With a topological polar surface area (TPSA) of 32.3 Ų, 3-Buten-2-ol, 1-(propylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Buten-2-ol, 1-(propylamino)- 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 3-Buten-2-ol, 1-(propylamino)-?
The CAS number of 3-Buten-2-ol, 1-(propylamino)- is 85771-10-4.
What is the molecular formula of 3-Buten-2-ol, 1-(propylamino)-?
The molecular formula of 3-Buten-2-ol, 1-(propylamino)- is C7H15NO.
What is the molecular weight of 3-Buten-2-ol, 1-(propylamino)-?
The molecular weight of 3-Buten-2-ol, 1-(propylamino)- is 129.12 g/mol.
Where can I buy 3-Buten-2-ol, 1-(propylamino)-?
You can request a quote for 3-Buten-2-ol, 1-(propylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Buten-2-ol, 1-(propylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 3-Buten-2-ol, 1-(propylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.