N4-Acetylsulfanilamide

HCID 8482CAS 121-61-9
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIKey
PKOFBDHYTMYVGJ-UHFFFAOYSA-N
Molecular formula
C8H10N2O3S
Average molar mass
214.24 g/mol
Monoisotopic mass
214.04121318

Names & identifiers

Preferred name
N4-Acetylsulfanilamide
IUPAC
N-(4-sulfamoylphenyl)acetamide
English name
4-Acetamidobenzenesulfonamide
Molecular formula
C8H10N2O3S
Molecular weight
214.24

Names & synonyms

4-Acetamidobenzenesulfonamide121-61-9N-(4-Sulfamoylphenyl)acetamideAcetylsulfanilamidep-SulfamylacetanilideN4-ACETYLSULFANILAMIDENeotherapolErytrin4'-SulfamylacetanilideN4-Acetsulfanilamide4-Acetylaminobenzenesulfonamide4'-Sulfamoylacetanilide
Show more names
N-(4-SULFAMOYL-PHENYL)-ACETAMIDEa-319AcetylsulfamineAcetsulfanilamideN4-AcetylsulfamineACETSULPHANILAMIDE
Sulfanilamide-N4-acetateN'-Acetylsulphanilamide4'-Sulphamoylacetanilidep-Sulfamoylacetanilidep-(Acetylamino)benzenesulfonamidep-AcetamidobenzenesulfonamideAcetanilide, 4'-sulfamoyl-Acetamide, N-[4-(aminosulfonyl)phenyl]-

Database identifiers

CAS
121-61-9
PubChem CID
8482
DTXSID
DTXSID4041529
ChEMBL
CHEMBL687
UNII
340484WZ3L
EC Number
204-486-7
Nikkaji
J5.342B

Properties

Computed structural properties

XLogP
0
Topological polar surface area
97.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
14

Experimental & physicochemical properties

DrugsPharmaceuticals -> Antibiotics
PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
LogP0.0

Physicochemical properties

Melting point
214 · 214-217 °C
Boiling point
418.91 ℃[at · 418.91℃[at 101 325 Pa]
Density
1.3844 · 1.3844 (rough estimate)
vapor pressure
0 Pa · 0Pa at 25℃
refractive index
1.569 · 1.5690 (estimate)
storage temp.
Room Temperature

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 50% (2 of 4) of reports.

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Regulation (EC) No 1107/2009 (amended)

Status: Cease Manufacture Update: 04-08-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/20041

Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

rtecs
AE7015000
hs_code
2935909099
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant

Chemistry & industry

Uses & manufacturing

Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)

Applications

Usesp-Sulfamylacetanilide has been used as an inhibitor of mitochondrial isoenzyme carbonic anhydrase V inhibitiors. Vullo, Daniela

Uses4-Acetamidobenzenesulfonamide has been used as an inhibitor of mitochondrial isoenzyme carbonic anhydrase V inhibitiors. Vullo, Daniela

Upstream & downstream products

Upstream raw materials

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]

Related reactions

8 records
New reaction record

Linked notes

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