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N,N-Diethyl-2-(1-naphthyloxy)propanamide - 97%, high purity , CAS No.15299-99-7
Basic Description
Synonyms
NCGC00259373-01 | DEVRINOL [HSDB] | Propanamide, N,N-diethyl-2-(1-naphthalenyloxy)- | SY276679 | InChI=1/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3 | N,N-Diethyl-2-(1-naphthalenyloxy)propionamide | Propionamide,
Specifications & Purity
≥97%
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenes
Alternative Parents
Alkyl aryl ethers Tertiary carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Naphthalene - Alkyl aryl ether - Tertiary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors
Amide herbicides
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
Mechanism of Action
Action Type
target ID
Target Name
Target Type
Target Organism
Binding Site Name
References
Names and Identifiers
Pubchem Sid
504753351
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504753351
IUPAC Name
N,N-diethyl-2-naphthalen-1-yloxypropanamide
INCHI
InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3
InChIKey
WXZVAROIGSFCFJ-UHFFFAOYSA-N
Smiles
CCN(CC)C(=O)C(C)OC1=CC=CC2=CC=CC=C21
Isomeric SMILES
CCN(CC)C(=O)C(C)OC1=CC=CC2=CC=CC=C21
WGK Germany
2
RTECS
UE3600000
Molecular Weight
271.35
Beilstein
6809160
Reaxy-Rn
2217870
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2217870&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Melt Point(°C)
73-78°C
Molecular Weight
271.350 g/mol
XLogP3
3.400
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
5
Exact Mass
271.157 Da
Monoisotopic Mass
271.157 Da
Topological Polar Surface Area
29.500 Ų
Heavy Atom Count
20
Formal Charge
0
Complexity
314.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
1.
Yucong Zheng, Dongxian Zhang, Zhuanzhuan Sun, Qian Yang, Ying Liu, Ting Cao, Rong Chen, Mawuli Dzakpasu, Xiaochang C. Wang.
(2022)
Stereoselective degradation pathway of amide chiral herbicides and its impacts on plant and bacterial communities in integrated vertical flow constructed wetlands. BIORESOURCE TECHNOLOGY,
351
(126997).
2.
Jing Zhao, Zhaorui Meng, Zexin Zhao, Longshan Zhao.
(2020)
Ultrasound-assisted deep eutectic solvent as green and efficient media combined with functionalized magnetic multi-walled carbon nanotubes as solid-phase extraction to determine pesticide residues in food products. FOOD CHEMISTRY,
310
(125863).
3.
Yingjie Li, Yimin Tang, Shili Qin, Xue Li, Qiang Dai, Lidi Gao.
(2019)
Preparation and characterization of a new open-tubular capillary column for enantioseparation by capillary electrochromatography. CHIRALITY,
31
(4):
(283-292).
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3 Citations
B2429285