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N-Cyclohexyl 4-fluorobenzenesulfonamide - 98%, high purity , CAS No.565-40-2
Discover N-Cyclohexyl 4-fluorobenzenesulfonamide by Aladdin Scientific in 98% for only $1,566.90. Available - in Ligands at Aladdin Scientific. Tags: .
Basic Description
Synonyms
N-CYCLOHEXYL 4-FLUOROBENZENESULFONAMIDE | 565-40-2 | N-cyclohexyl-4-fluorobenzenesulfonamide | N-Cyclohexyl4-fluorobenzenesulfonamide | N-cyclohexyl-4-fluorobenzene-1-sulfonamide | Oprea1_571586 | Oprea1_657770 | SCHEMBL14842346 | DTXSID70355392 | YUSOTJWNKVVYIR-UHFFFAOYSA
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonamides
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonamides
Alternative Parents
Benzenesulfonyl compounds Fluorobenzenes Organosulfonamides Aryl fluorides Aminosulfonyl compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonamide - Benzenesulfonyl group - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Organosulfur compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring.
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
N-cyclohexyl-4-fluorobenzenesulfonamide
INCHI
InChI=1S/C12H16FNO2S/c13-10-6-8-12(9-7-10)17(15,16)14-11-4-2-1-3-5-11/h6-9,11,14H,1-5H2
InChIKey
YUSOTJWNKVVYIR-UHFFFAOYSA-N
Smiles
C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)F
Isomeric SMILES
C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)F
Molecular Weight
257.3
Reaxy-Rn
3345021
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3345021&ln=
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight
257.329 g/mol
XLogP3
2.800
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
3
Exact Mass
257.089 Da
Monoisotopic Mass
257.089 Da
Topological Polar Surface Area
54.600 Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
325.000
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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