Basic information
- CAS
4981-47-9- Standard SMILES
CCCCOCNC(=O)NCOCCCC- InChIKey
FXTTXOYMDFLEKM-UHFFFAOYSA-N- Molecular formula
- C11H24N2O3
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.17869263
Names & identifiers
- Preferred name
- 1,3-Bis(butoxymethyl)urea
- IUPAC
- 1,3-bis(butoxymethyl)urea
- English name
- 1,3-bis(butoxymethyl)urea
- Molecular formula
- C11H24N2O3
- Molecular weight
- 232.32
Names & synonyms
1,3-Bis(butoxymethyl)ureaN,N'-Bis(butoxymethyl)ureaUrea, N,N'-bis(butoxymethyl)-2ER5HFS96FEINECS 225-630-5DTXSID4063662DIMETHYLOLUREA DIBUTYL ETHERRefChem:196760DTXCID6040747225-630-54981-47-9Dimethylol urea dibutyl ether
Show more names
1,3-bis-(Butoxymethyl)ureaUNII-2ER5HFS96FSCHEMBL11640897FXTTXOYMDFLEKM-UHFFFAOYSA-NAKOS040767817NS00031970
Database identifiers
- CAS
4981-47-9- PubChem CID
- 78679
- DTXSID
DTXSID4063662- UNII
- 2ER5HFS96F
- EC Number
- 225-630-5
- Nikkaji
- J203.219H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 93 °C · 93 °C
- Boiling point
- 366.6 · 366.6±27.0 °C(Predicted)
- Density
- 0.977 · 0.977±0.06 g/cm3(Predicted)
- pka
- 12.12 · 12.12±0.46(Predicted)
- FDA UNII
- 2 ER5HFS96F · 2ER5HFS96F
- EPA Substance Registry System
- N,N'-Bis(butoxymethyl)urea (4981-47-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationUrea, N,N'-bis(butoxymethyl)-: INACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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