Basic information
- CAS
303990-31-0- Standard SMILES
CCc1cccc(C)c1NC(=O)c1cc(OC)c(OC)c(OC)c1- InChIKey
NVUOHEVYIIOAQW-UHFFFAOYSA-N- Molecular formula
- C19H23NO4
- Average molar mass
- 329.4 g/mol
- Monoisotopic mass
- 329.16270821
Names & identifiers
- Preferred name
- N-(2-Ethyl-6-methylphenyl)-3,4,5-trimethoxybenzamide
- IUPAC
- N-(2-ethyl-6-methylphenyl)-3,4,5-trimethoxybenzamide
- English name
- N-(2-ethyl-6-methylphenyl)-3,4,5-trimethoxybenzamide
- Molecular formula
- C19H23NO4
- Molecular weight
- 329.39
Names & synonyms
N-(2-ethyl-6-methylphenyl)-3,4,5-trimethoxybenzamide303990-31-0RefChem:825339660-559-7Cambridge id 5868591Oprea1_049672Oprea1_778876AKOS000534162EU-0068794ST50330912AO-548/11380342SR-01000405207
Show more names
Benzamide, N-(2-ethyl-6-methylphenyl)-3,4,5-trimethoxy-
SR-01000405207-1Z28147469N-(6-ethyl-2-methylphenyl)(3,4,5-trimethoxyphenyl)carboxamide
Database identifiers
- CAS
303990-31-0- PubChem CID
- 680294
- EC Number
- 660-559-7
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Boiling point
- 411.9 · 411.9±45.0 °C(Predicted)
- Density
- 1.138 · 1.138±0.06 g/cm3(Predicted)
- pka
- 12.86 · 12.86±0.70(Predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-P501
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
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 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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