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2-Meo-4-(2-((4-methoxyanilino)(oxo)AC)carbohydrazonoyl)phenyl 4-ethoxybenzoate

HCID 9632110
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Basic information

CAS
769148-31-4
Standard SMILES
CCOc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)C(=O)Nc3ccc(OC)cc3)cc2OC)cc1
InChIKey
VIUDDVUXXCJXKK-JVWAILMASA-N
Molecular formula
C26H25N3O7
Average molar mass
491.5 g/mol
Monoisotopic mass
491.16925015

Names & identifiers

Preferred name
2-Meo-4-(2-((4-methoxyanilino)(oxo)AC)carbohydrazonoyl)phenyl 4-ethoxybenzoate
IUPAC
[2-methoxy-4-[(E)-[[2-(4-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 4-ethoxybenzoate

Names & synonyms

769148-31-42-MEO-4-(2-((4-METHOXYANILINO)(OXO)AC)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATERefChem:473991643-449-3AKOS024415665

Database identifiers

CAS
769148-31-4
PubChem CID
9632110
EC Number
643-449-3

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
125 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
36
Formal charge
0
Complexity
746

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 · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, 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.

Hazard information

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

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Compound notes

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