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Succinylsulfathiazole monohydrate

HCID 8308
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
6101-17-3
Standard SMILES
O.O=C(O)CCC(=O)Nc1ccc(S(=O)(=O)Nc2nccs2)cc1
InChIKey
QZIZYTCUSHTEBJ-UHFFFAOYSA-N
Molecular formula
C13H15N3O6S2
Average molar mass
373.4 g/mol
Monoisotopic mass
373.04022755

Names & identifiers

Preferred name
Succinylsulfathiazole monohydrate
IUPAC
4-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]butanoic acid;hydrate
English name
N4-Succinylsulfathiazole monohydrate
Molecular formula
C13H13N3O5S2.H2O
Molecular weight
373.41

Names & synonyms

Succinylsulfathiazole monohydrate6101-17-3HM7K18OJZ9RefChem:932344N4-Succinylsulfathiazole monohydrateUNII-HM7K18OJZ94-oxo-4-[4-(1,3-thiazol-2-ylsulfamoyl)anilino]butanoic acid;hydrateSulfasuxidine (TN)MFCD00150307DTXSID10976489Succinylsulfathiazole mono hydrateC13H15N3O6S2
Show more names
N4-Succinylsulfathiazole 1-hydrateSUCCINYLSULFATHIAZOLE, MONOHYDRATEN4-SUCCINYLSULFATHIAZOLE MONOHYDRATE_VET RANAL, 250 MGButanoic acid, 4-oxo-4-[[4-[(2-thiazolylamino)sulfonyl]phenyl]amino]-, hydrate (1:1)
AKOS024319090SUCCINYLSULFATHIAZOLE MONOHYDRATE [MI]D02447Q272800054-oxo-4-[4-(thiazol-2-ylsulfamoyl)anilino]butanoic acid;hydrate4-oxo-4-{4-[(1,3-thiazol-2-ylamino)sulfonyl]anilino}butanoic acid hydrate4-Oxo-4-{4-[(1,3-thiazol-2-yl)sulfamoyl]anilino}butanoic acid--water (1/1)BUTANOIC ACID, 4-OXO-4-((4-((2-THIAZOLYLAMINO)SULFONYL)PHENYL)AMINO)-, MONOHYDRATE

Database identifiers

CAS
6101-17-3
PubChem CID
8308

Properties

Computed structural propertiesFilling in

Topological polar surface area
163 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
9
Rotatable bonds
7
Heavy atoms
24
Formal charge
0
Complexity
526

Physicochemical properties

FDA UNII
7 K18OJZ9 · HM7K18OJZ9
Safety Statements
22 · 22-24/25

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 5 items

Warning

H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Sens. 1 (100%)

Safety data

safety_code
22-24/25

Chemistry & industry

Suppliers2 total

斯百全化学(上海)有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
DTXSID
DTXSID10976489
UNII
HM7K18OJZ9
EC Number
118-498-4