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Benzenesulfonyl hydrazide - 98%, high purity , CAS No.80-17-1
Basic Description
Synonyms
UNII-AC8C87U2TA | AI3-52515 | Benzenesulfonic acid, hydrazide | SCHEMBL1109 | Celogen BSH | benzenesulfono hydrazide | BENZENESULFONYL HYDRAZIDE [MI] | Benzensulfonylhydrazine | BSH | Genitron BSH | BBL000063 | W-104245 | Benzensulfonyl hydrazine | Benzen
Specifications & Purity
≥98%
Storage Temp
Argon charged
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 Sulfonohydrazides Hydrazinosulfonyl compounds Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzenesulfonamide - Benzenesulfonyl group - Hydrazinosulfonyl compound - Sulfonohydrazide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur 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
Pubchem Sid
504754000
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504754000
IUPAC Name
benzenesulfonohydrazide
INCHI
InChI=1S/C6H8N2O2S/c7-8-11(9,10)6-4-2-1-3-5-6/h1-5,8H,7H2
InChIKey
VJRITMATACIYAF-UHFFFAOYSA-N
Smiles
C1=CC=C(C=C1)S(=O)(=O)NN
Isomeric SMILES
C1=CC=C(C=C1)S(=O)(=O)NN
WGK Germany
3
RTECS
DB6888000
UN Number
3226
Molecular Weight
172.2
Beilstein
640079
Reaxy-Rn
640079
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=640079&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in Methanol
Sensitivity
light sensitive;Air sensitive
Flash Point(°F)
110℃
Flash Point(°C)
110℃
Melt Point(°C)
100-104°C
Molecular Weight
172.210 g/mol
XLogP3
-0.100
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
172.031 Da
Monoisotopic Mass
172.031 Da
Topological Polar Surface Area
80.600 Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
201.000
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
Citations of This Product
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