2-Buten-1-amine, N-butyl-, (E)-
TL;DR: 2-Buten-1-amine, N-butyl-, (E)- (CAS 62337-86-4) is a chemical compound with molecular formula C8H17N and molecular weight 127.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-but-2-enyl]butan-1-amine
Also Known As: (E)-N-Butyl-2-buten-1-amine, 2-Buten-1-amine, N-butyl-, (E)-, N-[(E)-but-2-enyl]butan-1-amine, (2E)-n-Butyl-2-buten-1-amine #, [(2E)-but-2-en-1-yl](butyl)amine
| Molecular Formula | C8H17N |
|---|---|
| Molecular Weight | 127.14 g/mol |
| LogP | 1.9522 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 127.1361 |
| Heavy Atoms | 9 |
| Complexity | 66.96789 |
Chemical Identifiers
| CAS Number | 62337-86-4 |
|---|---|
| SMILES | CCCCNC/C=C/C |
Product Overview
2-Buten-1-amine, N-butyl-, (E)- (CAS 62337-86-4), with molecular formula C8H17N and molecular weight 127.14 g/mol. IUPAC: N-[(E)-but-2-enyl]butan-1-amine.
Chemical Property Profile of 2-Buten-1-amine, N-butyl-, (E)-
Property Insights of 2-Buten-1-amine, N-butyl-, (E)-
The XLogP value of 1.9522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Buten-1-amine, N-butyl-, (E)-. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Buten-1-amine, N-butyl-, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Buten-1-amine, N-butyl-, (E)- 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 2-Buten-1-amine, N-butyl-, (E)-?
The CAS number of 2-Buten-1-amine, N-butyl-, (E)- is 62337-86-4.
What is the molecular formula of 2-Buten-1-amine, N-butyl-, (E)-?
The molecular formula of 2-Buten-1-amine, N-butyl-, (E)- is C8H17N.
What is the molecular weight of 2-Buten-1-amine, N-butyl-, (E)-?
The molecular weight of 2-Buten-1-amine, N-butyl-, (E)- is 127.14 g/mol.
Where can I buy 2-Buten-1-amine, N-butyl-, (E)-?
You can request a quote for 2-Buten-1-amine, N-butyl-, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Buten-1-amine, N-butyl-, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Buten-1-amine, N-butyl-, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.