2-Ethoxy-4-(2-(4-nitrobenzoyl)carbohydrazonoyl)phenyl 2,4-dichlorobenzoate
Basic information
- CAS
357300-74-4- Standard SMILES
CCOc1cc(/C=N/NC(=O)c2ccc([N+](=O)[O-])cc2)ccc1OC(=O)c1ccc(Cl)cc1Cl- InChIKey
BNOCMDCHADIWEG-LGJNPRDNSA-N- Molecular formula
- C23H17Cl2N3O6
- Average molar mass
- 502.3 g/mol
- Monoisotopic mass
- 501.0494407
Names & identifiers
- Preferred name
- 2-Ethoxy-4-(2-(4-nitrobenzoyl)carbohydrazonoyl)phenyl 2,4-dichlorobenzoate
- IUPAC
- [2-ethoxy-4-[(E)-[(4-nitrobenzoyl)hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
Names & synonyms
2-ETHOXY-4-(2-(4-NITROBENZOYL)CARBOHYDRAZONOYL)PHENYL 2,4-DICHLOROBENZOATERefChem:471569357300-74-4647-382-0AKOS024408422
Database identifiers
- CAS
357300-74-4- PubChem CID
- 9607915
- EC Number
- 647-382-0
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 741
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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 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 Sens. 1 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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