2-Fluoroisonicotinic acid hydrazide
Basic information
- CAS
369-24-4- Standard SMILES
NNC(=O)c1ccnc(F)c1- InChIKey
VYNMVVHQLHUXOK-UHFFFAOYSA-N- Molecular formula
- C6H6FN3O
- Average molar mass
- 155.13 g/mol
- Monoisotopic mass
- 155.04948999
Overview
structure in first source
Names & identifiers
- Preferred name
- 2-Fluoroisonicotinic acid hydrazide
- IUPAC
- 2-fluoropyridine-4-carbohydrazide
- English name
- 2-Fluoroisoniazide
- Molecular formula
- C6H6FN3O
- Molecular weight
- 155.13
Names & synonyms
2-Fluoroisonicotinic acid hydrazideRefChem:909835369-24-42-Fluoroisoniazide2-fluoropyridine-4-carbohydrazide2-Fluoroisonicotinohydrazide4-Pyridinecarboxylic acid, 2-fluoro-, hydrazideNSC280613CHEMBL331995SCHEMBL2997667DTXSID80314076MFCD08689558
Show more names
2-fluoro-4-pyridinecarbohydrazide4-Pyridinecarboxylicacid, 2-fluoro-, hydrazide
AKOS006290002NSC-280613SB86406AS-57069CS-0451721Pyridine, 2-fluoro-4-carboxylic acid, hydrazide
Database identifiers
- CAS
369-24-4- PubChem CID
- 322553
- DTXSID
DTXSID80314076- ChEMBL
CHEMBL331995- Nikkaji
- J1.604.822D
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 153
Experimental & physicochemical properties
LogP-0.11
Physicochemical properties
- Melting point
- 218 · 218-220 °C
- Density
- 1.356 · 1.356±0.06 g/cm3(Predicted)
- pka
- 10.53 · 10.53±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2933399990 · 2933399990
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
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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