Basic information
- CAS
7723-34-4- Standard SMILES
O=C(O)CNNC(=O)c1ccncc1- InChIKey
MWBUFKBOLFMKFU-UHFFFAOYSA-N- Molecular formula
- C8H9N3O3
- Average molar mass
- 195.18 g/mol
- Monoisotopic mass
- 195.06439116
Names & identifiers
- Preferred name
- (2-Isonicotinoylhydrazino)acetic acid
- IUPAC
- 2-[2-(pyridine-4-carbonyl)hydrazinyl]acetic acid
- English name
- 4-Pyridinecarboxylicacid,2-(carboxymethyl)hydrazide(9CI)
- Molecular formula
- C8H9N3O3
- Molecular weight
- 195.18
Names & synonyms
7723-34-4(2-Isonicotinoylhydrazino)acetic acidSCHEMBL2998085DTXSID601016430DB-283923[2-(Pyridine-4-carbonyl)hydrazinyl]acetic acid4-Pyridinecarboxylic acid, 2-(carboxymethyl)hydrazide4-Pyridinecarboxylicacid,2-(carboxymethyl)hydrazide(9CI)
Database identifiers
- CAS
7723-34-4- PubChem CID
- 202147
- DTXSID
DTXSID601016430
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- Melting point
- 192.5 °C · 192.5 °C(Solv: methanol (67-56-1))
- Boiling point
- 382.1 · 382.1±38.0 °C(Predicted)
- Density
- 1.365 · 1.365±0.06 g/cm3(Predicted)
- pka
- 4.46 · 4.46±0.10(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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