Basic information
- CAS
84379-38-4- Standard SMILES
COc1ccc(C)cc1N1CCCN(c2cc(C)ccc2OC)C1=O- InChIKey
BHFLLKKPCKQLOU-UHFFFAOYSA-N- Molecular formula
- C20H24N2O3
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.17869263
Names & identifiers
- Preferred name
- 1,3-Bis(2-methoxy-5-methylphenyl)tetrahydro-2(1H)-pyrimidinone
- IUPAC
- 1,3-bis(2-methoxy-5-methylphenyl)-1,3-diazinan-2-one
- English name
- 1,3-bis(2-methoxy-5-methylphenyl)-1,3-diazinan-2-one
- Molecular formula
- C20H24N2O3
- Molecular weight
- 340.41616
Names & synonyms
84379-38-41,3-BIS(2-METHOXY-5-METHYLPHENYL)TETRAHYDRO-2(1H)-PYRIMIDINONERefChem:413957651-435-31,3-Bis(2-methoxy-5-methylphenyl)tetrahydropyrimidin-2(1H)-oneAKOS0243305041,3-bis(2-methoxy-5-methylphenyl)-1,3-diazinan-2-one
Database identifiers
- CAS
84379-38-4- PubChem CID
- 680447
- EC Number
- 651-435-3
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 420
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
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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