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N-(2-Oxo-2-(2-(3,4,5-trimethoxybenzylidene)hydrazino)ethyl)-4-propoxybenzamide

HCID 9633604
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Basic information

CAS
769147-34-4
Standard SMILES
CCCOc1ccc(C(=O)NCC(=O)N/N=C/c2cc(OC)c(OC)c(OC)c2)cc1
InChIKey
VWTAGIDBCOQWEX-ZMOGYAJESA-N
Molecular formula
C22H27N3O6
Average molar mass
429.5 g/mol
Monoisotopic mass
429.18998559

Names & identifiers

Preferred name
N-(2-Oxo-2-(2-(3,4,5-trimethoxybenzylidene)hydrazino)ethyl)-4-propoxybenzamide
IUPAC
N-[2-oxo-2-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]ethyl]-4-propoxybenzamide

Names & synonyms

N-(2-OXO-2-(2-(3,4,5-TRIMETHOXYBENZYLIDENE)HYDRAZINO)ETHYL)-4-PROPOXYBENZAMIDERefChem:825676769147-34-4643-649-0AKOS024415771

Database identifiers

CAS
769147-34-4
PubChem CID
9633604
EC Number
643-649-0

Properties

Computed structural properties

XLogP
3
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
11
Heavy atoms
31
Formal charge
0
Complexity
566

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 · 4 items

Warning

H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]

P273, 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.

Hazard information

Hazard Classes and CategoriesAquatic Acute 1 (100%)

Related reactions

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Compound notes

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