1-(Methylsulfonyl)piperidine-3-carbohydrazide
Basic information
- CAS
832741-28-3- Standard SMILES
CS(=O)(=O)N1CCCC(C(=O)NN)C1- InChIKey
BRRAJOZHRMFWDD-UHFFFAOYSA-N- Molecular formula
- C7H15N3O3S
- Average molar mass
- 221.28 g/mol
- Monoisotopic mass
- 221.08341252
Names & identifiers
- Preferred name
- 1-(Methylsulfonyl)piperidine-3-carbohydrazide
- IUPAC
- 1-methylsulfonylpiperidine-3-carbohydrazide
- English name
- 1-(methylsulfonyl)piperidine-3-carbohydrazide(SALTDATA: FREE)
- Molecular formula
- C7H15N3O3S
- Molecular weight
- 221.28
Names & synonyms
1-(methylsulfonyl)piperidine-3-carbohydrazide832741-28-31-methanesulfonylpiperidine-3-carbohydrazide1-methylsulfonylpiperidine-3-carbohydrazideMFCD049698731-Methanesulfonyl-piperidine-3-carboxylic acid hydrazide1-(Methanesulfonyl)piperidine-3-carbohydrazideSCHEMBL20837307DTXSID20398734ALBB-002833BBL014087SBB022119
Show more names
1-mesylnipecotohydrazide1-methylsulfonyl-3-piperidinecarbohydrazide3-Piperidinecarboxylic acid, 1-(methylsulfonyl)-, hydrazide1-(methylsulfonyl)piperidine-3-carbohydrazide(SALTDATA: FREE)
STK299310AKOS000310376AT32264SB44092VS-04171ST45092616EN300-229598F026570
Database identifiers
- CAS
832741-28-3- PubChem CID
- 4045908
- DTXSID
DTXSID20398734- EC Number
- 189-180-0
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 12.98 · 12.98±0.20(Predicted)
- Comptox DTXSID
- 20398734 · DTXSID20398734
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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