4-羟基-4-(十八烷基亚氨基)丁-2-烯酸
TL;DR: 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 (CAS 6668-52-6) is a chemical compound with molecular formula C22H41NO3 and molecular weight 367.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-羟基-4-(十八烷基亚氨基)丁-2-烯酸
4-(octadecylamino)-4-oxobut-2-enoic acid
Also Known As: N-Octadecylmaleamic acid, 4-(Octadecylamino)-4-oxoisocrotonic acid, 4-(octadecylamino)-4-oxobut-2-enoic acid, AI3-09140, 4-Hydroxy-4-(octadecylimino)but-2-enoic acid
| Molecular Formula | C22H41NO3 |
|---|---|
| Molecular Weight | 367.31 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 19 |
| Exact Mass | 367.30865 |
| Heavy Atoms | 26 |
| Complexity | 366.0 |
Chemical Identifiers
| CAS Number | 6668-52-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCNC(=O)C=CC(=O)O |
| InChIKey | NWODYZCQADERLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 (CAS 6668-52-6), with molecular formula C22H41NO3 and molecular weight 367.31 g/mol. IUPAC: 4-(octadecylamino)-4-oxobut-2-enoic acid.
Chemical Property Profile of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸
Property Insights of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸
The XLogP value of 8.1 indicates that 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸. Following Lipinski's Rule of Five, 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 has 2 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 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸?
The CAS number of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 is 6668-52-6.
What is the molecular formula of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸?
The molecular formula of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 is C22H41NO3.
What is the molecular weight of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸?
The molecular weight of 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 is 367.31 g/mol.
Where can I buy 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸?
You can request a quote for 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸?
Yes, KEHONG BIO provides custom synthesis services for 4-羟基-4-(十八烷基亚氨基)丁-2-烯酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.