Basic information
- CAS
956611-52-2- Standard SMILES
COc1ccc(C2(C)NC(=O)NC2=O)cc1OC- InChIKey
JXEXQYITISXIQL-UHFFFAOYSA-N- Molecular formula
- C12H14N2O4
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.09535693
Names & identifiers
- Preferred name
- 5-(3,4-Dimethoxyphenyl)-5-methylimidazolidine-2,4-dione
- IUPAC
- 5-(3,4-dimethoxyphenyl)-5-methylimidazolidine-2,4-dione
- English name
- 5-(3,4-Dimethoxy-phenyl)-5-methyl-imidazolidine-2,4-dione
- Molecular formula
- C12H14N2O4
- Molecular weight
- 250.25
Names & synonyms
5-(3,4-dimethoxyphenyl)-5-methylimidazolidine-2,4-dione956611-52-2RefChem:529701820-282-65-(3,4-Dimethoxy-phenyl)-5-methyl-imidazolidine-2,4-dioneMLS001166705SCHEMBL542564CHEMBL1502992HMS2887O07AKOS000200606AKOS016385661SMR000589522
Show more names
2,4-Imidazolidinedione, 5-(3,4-dimethoxyphenyl)-5-methyl-
DB-123642EN300-04895SR-01000039517SR-01000039517-1Z56886582
Database identifiers
- CAS
956611-52-2- PubChem CID
- 3559619
- ChEMBL
CHEMBL1502992- EC Number
- 820-282-6
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 360
Experimental & physicochemical properties
Solubility>37.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers2 total
合肥孚亚生物技术有限公司18096409024 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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