HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

4-Methoxy-N-(2-oxo-2-(2-(2,3,4-trimethoxybenzylidene)hydrazino)ethyl)benzamide

HCID 9630992
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
769157-05-3
Standard SMILES
COc1ccc(C(=O)NCC(=O)N/N=C/c2ccc(OC)c(OC)c2OC)cc1
InChIKey
NDXOKIHUPOWAAF-SSDVNMTOSA-N
Molecular formula
C20H23N3O6
Average molar mass
401.4 g/mol
Monoisotopic mass
401.15868546

Names & identifiers

Preferred name
4-Methoxy-N-(2-oxo-2-(2-(2,3,4-trimethoxybenzylidene)hydrazino)ethyl)benzamide
IUPAC
4-methoxy-N-[2-oxo-2-[(2E)-2-[(2,3,4-trimethoxyphenyl)methylidene]hydrazinyl]ethyl]benzamide

Names & synonyms

4-METHOXY-N-(2-OXO-2-(2-(2,3,4-TRIMETHOXYBENZYLIDENE)HYDRAZINO)ETHYL)BENZAMIDERefChem:524676769157-05-3643-554-4AKOS024415793

Database identifiers

CAS
769157-05-3
PubChem CID
9630992
EC Number
643-554-4

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
9
Heavy atoms
29
Formal charge
0
Complexity
550

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

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes