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Procymidone Solution in Acetonitrile - 1000μg/mL in Acetonitrile,Uncertainty 2%, high purity , CAS No.32809-16-8
Basic Description
Synonyms
5-methoxy-2-(trifluoromethyl)-Benzoic acid | AS-75497 | InChI=1/C13H11Cl2NO2/c1-12-6-13(12,2)11(18)16(10(12)17)9-4-7(14)3-8(15)5-9/h3-5H,6H2,1-2H3 | AB00078702-01 | NCGC00091017-02 | NCGC00257305-01 | DTXSID9033923 | HMS3073A16 | Procymidone 10 microg/mL
Specifications & Purity
1000μg/mL in Acetonitrile,Uncertainty 2%
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Phenylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpiperidines
Alternative Parents
Phenylpyrrolidines Piperidinediones Dichlorobenzenes Delta lactams Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Pyrroles Dicarboximides Azacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Carbonyl compounds Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperidine - 1-phenylpyrrolidine - 1,3-dichlorobenzene - Piperidinedione - Chlorobenzene - Delta-lactam - Halobenzene - Piperidinone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Pyrrolidine - Pyrrole - Dicarboximide - Lactam - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organopnictogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperidines. These are compounds containing a phenylpiperidine skeleton, which consists of a piperidine bound to a phenyl group.
External Descriptors
Dicarboximide fungicides
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
IUPAC Name
3-(3,5-dichlorophenyl)-1,5-dimethyl-3-azabicyclo[3.1.0]hexane-2,4-dione
INCHI
InChI=1S/C13H11Cl2NO2/c1-12-6-13(12,2)11(18)16(10(12)17)9-4-7(14)3-8(15)5-9/h3-5H,6H2,1-2H3
InChIKey
QXJKBPAVAHBARF-UHFFFAOYSA-N
Smiles
CC12CC1(C(=O)N(C2=O)C3=CC(=CC(=C3)Cl)Cl)C
Isomeric SMILES
CC12CC1(C(=O)N(C2=O)C3=CC(=CC(=C3)Cl)Cl)C
WGK Germany
2
RTECS
GZ2150000
Molecular Weight
284.14
Beilstein
1539058
Reaxy-Rn
1539058
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1539058&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°F)
>100 °C
Flash Point(°C)
>100°C
Molecular Weight
284.130 g/mol
XLogP3
3.000
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
283.017 Da
Monoisotopic Mass
283.017 Da
Topological Polar Surface Area
37.400 Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
405.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
2
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
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