N-(2-Isopropylphenyl)-3,4,5-trimethoxybenzamide
Basic information
- CAS
303990-32-1- Standard SMILES
COc1cc(C(=O)Nc2ccccc2C(C)C)cc(OC)c1OC- InChIKey
VNKUUKSPNWBREU-UHFFFAOYSA-N- Molecular formula
- C19H23NO4
- Average molar mass
- 329.4 g/mol
- Monoisotopic mass
- 329.16270821
Names & identifiers
- Preferred name
- N-(2-Isopropylphenyl)-3,4,5-trimethoxybenzamide
- IUPAC
- 3,4,5-trimethoxy-N-(2-propan-2-ylphenyl)benzamide
- English name
- N-(2-isopropylphenyl)-3,4,5-trimethoxybenzamide
- Molecular formula
- C19H23NO4
- Molecular weight
- 329.39022
Names & synonyms
N-(2-isopropylphenyl)-3,4,5-trimethoxybenzamide303990-32-1RefChem:825516662-570-23,4,5-trimethoxy-N-(2-propan-2-ylphenyl)benzamideOprea1_295734Oprea1_342336AKOS000534163ST111693ST50234834AO-548/11380343N-[2-(methylethyl)phenyl](3,4,5-trimethoxyphenyl)carboxamide
Database identifiers
- CAS
303990-32-1- PubChem CID
- 680295
- EC Number
- 662-570-2
Properties
Computed structural properties
- XLogP
- 3.3
- 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
- 387
Physicochemical properties
- 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
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Related reactions
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Compound notes
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