CAS
94139-08-9 Purity
96%
94139-08-9 Purity
96%
Inquiry Basket
N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate
CAS
94139-11-4
Catalog Number
ACM94139114
Category
Other Products
Molecular Weight
408.61776
Molecular Formula
C22H42N2O2.C2H4O2
If you have any other questions or need other size, please get a quote.
- Product Description
- Case Study
- Custom Reviews
- Custom Q&A
- Synthetic Use
- Related Resources
Specification
Synonyms
EINECS 303-026-3, N-(2-((2-Hydroxyethyl)amino)ethyl)octadeca-9,12-dienamide monoacetate, 94139-11-4
IUPAC Name
[2-(ethylamino)ethyl-[(9E,12E)-octadeca-9,12-dienoyl]amino] acetate
Canonical SMILES
CCCCCC=CCC=CCCCCCCCC(=O)N(CCNCC)OC(=O)C
InChI Key
LNVRPBMYZQBPEZ-OKLKQMLOSA-N
Density
g/cm³
EC Number
303-026-3
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The molecular formula is C24H44N2O3.
When was N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate created and modified in PubChem?
It was created on August 20, 2009, and modified on December 30, 2023.
What is the IUPAC name of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The IUPAC name is [2-(ethylamino)ethyl-[(9E,12E)-octadeca-9,12-dienoyl]amino] acetate.
What is the InChI of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The InChI is InChI=1S/C24H44N2O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24(28)26(29-23(3)27)22-21-25-5-2/h9-10,12-13,25H,4-8,11,14-22H2,1-3H3/b10-9+,13-12+.
What is the Canonical SMILES of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The Canonical SMILES is CCCCCC=CCC=CCCCCCCCC(=O)N(CCNCC)OC(=O)C.
How many hydrogen bond donor counts does N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate have?
It has 1 hydrogen bond donor count.
What is the XLogP3-AA value of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The XLogP3-AA value is 6.5.
What is the topological polar surface area of N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate?
The topological polar surface area is 58.6 Ų.
How many rotatable bond counts does N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate have?
It has 20 rotatable bond counts.
Is N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12-dienamide monoacetate a canonicalized compound according to PubChem?
Yes, it is a canonicalized compound.
Recommended Products
![N-[2-[(2-Hydroxyethyl)amino]ethyl]dodecanamide monoacetate](https://resource.alfa-chemistry.com/structure/94139-08-9.gif)
![N-[2-[(2-Hydroxyethyl)amino]ethyl]myristamide monoacetate](https://resource.alfa-chemistry.com/structure/94139-09-0.gif)
CAS
94139-09-0 Purity
96%
94139-09-0 Purity
96%
![N-[2-[(2-Hydroxyethyl)amino]ethyl]palmitamide monoacetate](https://resource.alfa-chemistry.com/structure/94139-10-3.gif)
CAS
94139-10-3 Purity
---
94139-10-3 Purity
---
![N-[2-[(2-Hydroxyethyl)amino]ethyl]octadeca-9,12,15-trienamide monoacetate](https://resource.alfa-chemistry.com/structure/94139-12-5.gif)
CAS
94139-12-5 Purity
96%
94139-12-5 Purity
96%
