4-Pyridinecarboxylicacid, 2-(1-methyl-3-phenyl-2-propen-1-ylidene)hydrazide
Basic information
- CAS
4813-12-1- Standard SMILES
CC(C=Cc1ccccc1)=NNC(=O)c1ccncc1- InChIKey
COSOIDVYPRKBNX-UHFFFAOYSA-N- Molecular formula
- C16H15N3O
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.12151211
Names & identifiers
- Preferred name
- 4-Pyridinecarboxylicacid, 2-(1-methyl-3-phenyl-2-propen-1-ylidene)hydrazide
- IUPAC
- N-(4-phenylbut-3-en-2-ylideneamino)pyridine-4-carboxamide
- English name
- N-[[(E)-4-phenylbut-3-en-2-ylidene]amino]pyridine-4-carboxamide
- Molecular formula
- C16H15N3O
- Molecular weight
- 265.31
Names & synonyms
DTXSID702867984-Pyridinecarboxylicacid, 2-(1-methyl-3-phenyl-2-propen-1-ylidene)hydrazide4813-12-1RefChem:296052DTXCID10237946N'-(4-Phenylbut-3-en-2-ylidene)pyridine-4-carbohydrazideN'-(1-METHYL-3-PHENYL-2-PROPENYLIDENE)ISONICOTINOHYDRAZIDEN-[[(E)-4-phenylbut-3-en-2-ylidene]amino]pyridine-4-carboxamide
Database identifiers
- CAS
4813-12-1- PubChem CID
- 240873
- DTXSID
DTXSID70286798- EC Number
- 658-457-2
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 364
Physicochemical properties
- Melting point
- 158 · 158-160 °C
- Density
- 1.089 · 1.089±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.019 · 11.019±0.46(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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