2-Methylquinoline-4-carbohydrazide
Basic information
- CAS
29620-66-4- Standard SMILES
Cc1cc(C(=O)NN)c2ccccc2n1- InChIKey
FECUFBYEIDSVGX-UHFFFAOYSA-N- Molecular formula
- C11H11N3O
- Average molar mass
- 201.22 g/mol
- Monoisotopic mass
- 201.09021198
Names & identifiers
- Preferred name
- 2-Methylquinoline-4-carbohydrazide
- IUPAC
- 2-methylquinoline-4-carbohydrazide
- English name
- 2-Methyl-quinoline-4-carboxylic acid hydrazide
- Molecular formula
- C11H11N3O
- Molecular weight
- 201.22
Names & synonyms
2-methylquinoline-4-carbohydrazide29620-66-4DTXSID40332438RefChem:263998DTXCID80283531MFCD006810684-Quinolinecarboxylic acid, 2-methyl-, hydrazide2Me4QuinolCON22-methylcinchoninhydrazideOprea1_452004SCHEMBL5815673ALBB-002622
Show more names
2-methylcinchoninohydrazide2-methyl-4-quinolinecarbohydrazide2-methylquinoline-4-carbohydrazide(SALTDATA: FREE)
BBL013764STK397381AKOS000117792SB86550VS-039922-Methyl-4-quinolinecarboxyic acid hydrazideCS-0307682ST45161858
Database identifiers
- CAS
29620-66-4- PubChem CID
- 456702
- DTXSID
DTXSID40332438
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Melting point
- 75 °C · 75 °C
- Density
- 1.253 · 1.253±0.06 g/cm3(Predicted)
- pka
- 11.6 · 11.60±0.30(Predicted)
- InChI
- 1S/C11H11N3O/c1-7-6-9(11(15)14-12)8-4-2-3-5-10(8)13-7/h2-6H,12H2,1H3,(H,14,15)
- InChIKey
- FECUFBYEIDSVGX-UHFFFAOYSA-N
- SMILES
- Cc1cc(C(=O)NN)c2ccccc2n1
- UNSPSC Code
- 12352200 · 12352200
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
- WGK Germany
- 3 · WGK 3
- Storage Class
- 13 · 13 - Non Combustible Solids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2
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
- wgk
- WGK 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 13 - Non Combustible Solids
- Hazard statements
- H302-H319
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2
- Precautionary statements
- P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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