1-Butanamine, N-ethylidene-
TL;DR: 1-Butanamine, N-ethylidene- (CAS 6898-74-4) is a chemical compound with molecular formula C6H13N and molecular weight 99.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butylethanimine
Also Known As: N-butylethanimine, 1-Butanamine, N-ethylidene-, N-Butylethylideneamine, N-Ethylidenebutylamine, ethylidene-butyl-amine
| Molecular Formula | C6H13N |
|---|---|
| Molecular Weight | 99.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 99.1048 |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 6898-74-4 |
|---|---|
| SMILES | CCCCN=CC |
| InChIKey | NKGJJLDEORZFKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanamine, N-ethylidene- (CAS 6898-74-4), with molecular formula C6H13N and molecular weight 99.10 g/mol. IUPAC: N-butylethanimine.
Chemical Property Profile of 1-Butanamine, N-ethylidene-
Property Insights of 1-Butanamine, N-ethylidene-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanamine, N-ethylidene-. With a topological polar surface area (TPSA) of 12.4 Ų, 1-Butanamine, N-ethylidene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanamine, N-ethylidene- has 0 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-Butanamine, N-ethylidene-?
The CAS number of 1-Butanamine, N-ethylidene- is 6898-74-4.
What is the molecular formula of 1-Butanamine, N-ethylidene-?
The molecular formula of 1-Butanamine, N-ethylidene- is C6H13N.
What is the molecular weight of 1-Butanamine, N-ethylidene-?
The molecular weight of 1-Butanamine, N-ethylidene- is 99.10 g/mol.
Where can I buy 1-Butanamine, N-ethylidene-?
You can request a quote for 1-Butanamine, N-ethylidene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanamine, N-ethylidene-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanamine, N-ethylidene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.