2-Nitrobenzenesulfonamide - CAS 5455-59-4

Catalog:	BB028718
Product Name:	2-Nitrobenzenesulfonamide
CAS:	5455-59-4
Synonyms:	2-nitrobenzenesulfonamide

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-nitrobenzenesulfonamide
Description:	2-Nitrobenzenesulfonamide (CAS# 5455-59-4) is a carbonic anhydrase inhibitor.
Molecular Weight:	202.19
Molecular Formula:	C6H6N2O4S
Canonical SMILES:	C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)N
InChI:	InChI=1S/C6H6N2O4S/c7-13(11,12)6-4-2-1-3-5(6)8(9)10/h1-4H,(H2,7,11,12)
InChI Key:	GNDKYAWHEKZHPJ-UHFFFAOYSA-N
Boiling Point:	418.8 °C at 760 mmHg
Density:	1.552 g/cm³
MDL:	MFCD00009807
LogP:	2.54650

Publication Number	Title	Priority Date
CN-113336769-A	Thienopyrimidone acylsulfonamide derivative and preparation method and application thereof	20210430
CN-112920103-A	Method for mild preparation of 2-azaspiro [3.3] heptane hydrochloride	20210302
CN-112250684-A	Dimeric tryptamine compound and preparation method thereof	20201023
CN-111606970-A	1, 5-diazabicyclo [5,3,0] deca-alkanone amino acid derivative and preparation method and application thereof	20200605
EP-3896521-A1	Polymer, photosensitive resin composition, patterning method, method of forming cured film, interlayer insulating film, surface protective film, and electronic component	20200414

PMID	Publication Date	Title	Journal
29458015	20180325	Sulfenamide and sulfonamide derivatives of metformin can exert anticoagulant and profibrinolytic properties	Chemico-biological interactions
22412489	20120301	N-(4-Methyl-benzo-yl)-2-nitro-benzene-sulfonamide	Acta crystallographica. Section E, Structure reports online
22412658	20120301	N-(3-Chloro-benzo-yl)-2-nitro-benzene-sulfonamide	Acta crystallographica. Section E, Structure reports online
22346916	20120201	N-(2-Chloro-benzo-yl)-2-nitro-benzene-sulfonamide	Acta crystallographica. Section E, Structure reports online
22346969	20120201	N-Benzoyl-2-nitro-benzene-sulfonamide	Acta crystallographica. Section E, Structure reports online

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[35153-16-3]
(Z)-10-Tetradecenyl Acetate

Sulfur Compounds

[1866059-82-6]
1,1,2,2-Tetrafluoro-3-methylsulfonylpropane
[6633-90-5]
1,4-Butanedithiol diacetate
[85-47-2]
1-Naphthalenesulfonic acid
[104496-91-5]
2-(Pyridin-2-ylthio)acetohydrazide
[162894-76-0]
2-Hydroxyethane-1-sulfonamide
[72799-34-9]
3-(2-Ethoxyphenyl)-2-Thioxoimidazolidin-4-One

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	289
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.00482785
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	202.00482785
Rotatable Bond Count:	1
Topological Polar Surface Area:	114 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3