4-(2-(2,4-Dihydroxybenzoyl)carbohydrazonoyl)phenyl 2-thiophenecarboxylate
Basic information
- CAS
478635-96-0- Standard SMILES
O=C(Oc1ccc(/C=N/NC(=O)c2ccc(O)cc2O)cc1)c1cccs1- InChIKey
DOTCPCDPTRSPJB-RGVLZGJSSA-N- Molecular formula
- C19H14N2O5S
- Average molar mass
- 382.4 g/mol
- Monoisotopic mass
- 382.06234272
Names & identifiers
- Preferred name
- 4-(2-(2,4-Dihydroxybenzoyl)carbohydrazonoyl)phenyl 2-thiophenecarboxylate
- IUPAC
- [4-[(E)-[(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate
- English name
- SALOR-INT L459046-1EA
- Molecular formula
- C19H14N2O5S
- Molecular weight
- 382.39
Names & synonyms
4-(2-(2,4-DIHYDROXYBENZOYL)CARBOHYDRAZONOYL)PHENYL 2-THIOPHENECARBOXYLATERefChem:511435478635-96-0656-308-6AKOS024417161SALOR-INT L459046-1EA2-Thiophenecarboxylic acid, 4-[[2-(2,4-dihydroxybenzoyl)hydrazinylidene]methyl]phenyl ester
Database identifiers
- CAS
478635-96-0- PubChem CID
- 9617871
- EC Number
- 656-308-6
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 550
Physicochemical properties
- Density
- 1.4 · 1.40±0.1 g/cm3(Predicted)
- pka
- 8.08 · 8.08±0.35(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H315-H413-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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, P273, 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 39 reports by companies from 2 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
- H319-H315-H413-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…