Pyrimidine-2-sulfonamide
Basic information
- CAS
142047-90-3- Standard SMILES
NS(=O)(=O)c1ncccn1- InChIKey
WJJBIYLGJUVNJX-UHFFFAOYSA-N- Molecular formula
- C4H5N3O2S
- Average molar mass
- 159.17 g/mol
- Monoisotopic mass
- 159.01024758
Names & identifiers
- Preferred name
- Pyrimidine-2-sulfonamide
- IUPAC
- pyrimidine-2-sulfonamide
- English name
- 2-Pyrimidinesulfonamide(9CI)
- Molecular formula
- C4H5N3O2S
- Molecular weight
- 159.17
Names & synonyms
pyrimidine-2-sulfonamide142047-90-3DTXSID40595001RefChem:377688DTXCID00545764894-490-02-Pyrimidinesulfonamide2-Pyrimidinesulfonamide(9CI)pyrimidyl-sulfonamideMFCD11847597pyrimidine sulfonamideSCHEMBL51141
Show more names
SCHEMBL4847957CHEMBL4528470WJJBIYLGJUVNJX-UHFFFAOYSA-NSFA04790AKOS010995687SB56998SY059617DB-261428
Database identifiers
- CAS
142047-90-3- PubChem CID
- 18547005
- DTXSID
DTXSID40595001- ChEMBL
CHEMBL4528470- EC Number
- 894-490-0
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 189
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesAcute Tox. 4 (100%)
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Related reactions
0 records
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Compound notes
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