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4-cyanopiperidine-1-sulfonyl chloride - 97%, high purity , CAS No.1392803-35-8
Discover 4-cyanopiperidine-1-sulfonyl chloride by Aladdin Scientific in 97% for only $2,102.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
4-cyanopiperidine-1-sulfonyl chloride | 1392803-35-8 | 4-Cyano-1-piperidinesulfonylchloride | 4-Cyano-1-piperidinesulfonyl chloride | DTXSID001286263 | AMY34969 | 4-cyanopiperidine-1-sulfonylchloride | MFCD23106264 | AKOS025291226 | PB39228 | SB21071 | 1-Piperidinesulfonyl chl
Specifications & Purity
≥97%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Piperidines
Alternative Parents
Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Piperidine - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five carbon atoms.
External Descriptors
Not available
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.
Names and Identifiers
IUPAC Name
4-cyanopiperidine-1-sulfonyl chloride
INCHI
InChI=1S/C6H9ClN2O2S/c7-12(10,11)9-3-1-6(5-8)2-4-9/h6H,1-4H2
InChIKey
INTMACYJHWGRBL-UHFFFAOYSA-N
Smiles
C1CN(CCC1C#N)S(=O)(=O)Cl
Isomeric SMILES
C1CN(CCC1C#N)S(=O)(=O)Cl
Molecular Weight
208.66
Reaxy-Rn
35756781
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=35756781&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
208.670 g/mol
XLogP3
0.500
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
208.007 Da
Monoisotopic Mass
208.007 Da
Topological Polar Surface Area
69.600 Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
291.000
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
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