Basic information
- Standard SMILES
O=C(NNCS(=O)(=O)O)c1ccncc1- InChIKey
GQZQCROBCYNTMU-UHFFFAOYSA-N- Molecular formula
- C7H9N3O4S
- Average molar mass
- 231.23 g/mol
- Monoisotopic mass
- 231.03137677
Overview
Methaniazide is a pyridinemonocarboxylic acid and an aromatic carboxylic acid.
Names & identifiers
- Preferred name
- 4-Pyridinecarboxylic acid, 2-(sulfomethyl)hydrazide
- IUPAC
- [2-(pyridine-4-carbonyl)hydrazinyl]methanesulfonic acid
- English name
- methaniazide
- Molecular formula
- C7H9N3O4S
- Molecular weight
- 231.23
Names & synonyms
Methaniazide13447-95-5MetaniazidaMetaniazideMethaniazidumGN8S7ZES0FRefChem:9127984-Pyridinecarboxylic acid, 2-(sulfomethyl)hydrazideISONIAZIDE SODIUM METHANESULFONATE236-605-3Isoniazid methanesulfonate[2-(pyridine-4-carbonyl)hydrazinyl]methanesulfonic acid
Show more names
Methaniazidmethaniazide USP/EP/BP(N'-isonicotinoyl-hydrazino)-methanesulfonic acid
Methaniazide [INN]Methaniazide (INN)Isonicotinic acid 2-(sulfomethyl)hydrazineMetaniazide [DCIT]NCGC00181167-01UNII-GN8S7ZES0FMetaniazida [INN-Spanish]Methaniazidum [INN-Latin]
Database identifiers
- CAS
13447-95-5- PubChem CID
- 3769
- DTXSID
DTXSID2048248- ChEMBL
CHEMBL2105190- ChEBI
CHEBI:134943- UNII
- GN8S7ZES0F
- EC Number
- 236-605-3
- Nikkaji
- J8.114K
Properties
Computed structural properties
- XLogP
- -3.6
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Density
- 1.537 · 1.537±0.06 g/cm3(Predicted)
- pka
- 0.82 · 0.82±0.50(Predicted)
- FDA UNII
- 8 S7ZES0F · GN8S7ZES0F
Chemistry & industry
Suppliers3 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
Dideu Industries Group Limited+8617392712697 · [email protected]
Additional notes
DefinitionChEBI: Methaniazide is a pyridinemonocarboxylic acid and an aromatic carboxylic acid.
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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