1,1'-(4-Methyl-1,3-phenylene)bis(3-ethylurea)
Basic information
- CAS
25635-03-4- Standard SMILES
CCNC(=O)Nc1ccc(C)c(NC(=O)NCC)c1- InChIKey
KXIZTLVQHOBRKM-UHFFFAOYSA-N- Molecular formula
- C13H20N4O2
- Average molar mass
- 264.32 g/mol
- Monoisotopic mass
- 264.15862589
Names & identifiers
- Preferred name
- 1,1'-(4-Methyl-1,3-phenylene)bis(3-ethylurea)
- IUPAC
- 1-ethyl-3-[3-(ethylcarbamoylamino)-4-methylphenyl]urea
- English name
- 1,1'-(4-Methyl-1,3-phenylene)bis(3-ethylurea)
- Molecular formula
- C13H20N4O2
- Molecular weight
- 264.3235
Names & synonyms
1,1'-(4-Methyl-1,3-phenylene)bis(3-ethylurea)RefChem:40907625635-03-4667-359-9AKOS017100482ST50550353(ethylamino)-N-{3-[(ethylamino)carbonylamino]-4-methylphenyl}carboxamide
Database identifiers
- CAS
25635-03-4- PubChem CID
- 4429487
- EC Number
- 667-359-9
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 82.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, 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 CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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