(3-(二己基氨基)亚烯丙基)丙二腈
TL;DR: (3-(二己基氨基)亚烯丙基)丙二腈 (CAS 61600-15-5) is a chemical compound with molecular formula C18H29N3 and molecular weight 287.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-(二己基氨基)亚烯丙基)丙二腈
2-[3-(dihexylamino)prop-2-enylidene]propanedinitrile
Also Known As: (3-(Dihexylamino)allylidene)malononitrile, [3-(dihexylamino)allylidene]malononitrile, Propanedinitrile, (3-(dihexylamino)-2-propenylidene)-, Propanedinitrile, [3-(dihexylamino)-2-propenylidene]-, 2-[3-(dihexylamino)prop-2-enylidene]propanedinitrile
| Molecular Formula | C18H29N3 |
|---|---|
| Molecular Weight | 287.24 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 287.23615 |
| Heavy Atoms | 21 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 61600-15-5 |
|---|---|
| SMILES | CCCCCCN(CCCCCC)C=CC=C(C#N)C#N |
| InChIKey | UKMOTPPGNSDWRI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-(二己基氨基)亚烯丙基)丙二腈 (CAS 61600-15-5), with molecular formula C18H29N3 and molecular weight 287.24 g/mol. IUPAC: 2-[3-(dihexylamino)prop-2-enylidene]propanedinitrile.
Chemical Property Profile of (3-(二己基氨基)亚烯丙基)丙二腈
Property Insights of (3-(二己基氨基)亚烯丙基)丙二腈
The XLogP value of 5.6 indicates that (3-(二己基氨基)亚烯丙基)丙二腈 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, (3-(二己基氨基)亚烯丙基)丙二腈 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-(二己基氨基)亚烯丙基)丙二腈 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-(二己基氨基)亚烯丙基)丙二腈?
The CAS number of (3-(二己基氨基)亚烯丙基)丙二腈 is 61600-15-5.
What is the molecular formula of (3-(二己基氨基)亚烯丙基)丙二腈?
The molecular formula of (3-(二己基氨基)亚烯丙基)丙二腈 is C18H29N3.
What is the molecular weight of (3-(二己基氨基)亚烯丙基)丙二腈?
The molecular weight of (3-(二己基氨基)亚烯丙基)丙二腈 is 287.24 g/mol.
Where can I buy (3-(二己基氨基)亚烯丙基)丙二腈?
You can request a quote for (3-(二己基氨基)亚烯丙基)丙二腈 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-(二己基氨基)亚烯丙基)丙二腈?
Yes, KEHONG BIO provides custom synthesis services for (3-(二己基氨基)亚烯丙基)丙二腈 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.