1-Butyl-3-phenylurea
Basic information
- CAS
3083-88-3- Standard SMILES
CCCCNC(=O)Nc1ccccc1- InChIKey
DOUCJWNVCGEZRR-UHFFFAOYSA-N- Molecular formula
- C11H16N2O
- Average molar mass
- 192.26 g/mol
- Monoisotopic mass
- 192.12626314
Names & identifiers
- Preferred name
- 1-Butyl-3-phenylurea
- IUPAC
- 1-butyl-3-phenylurea
Names & synonyms
1-Butyl-3-phenylureaRefChem:431072653-447-43083-88-33-butyl-1-phenylureaN-Butyl-N'-phenylureaUrea, N-butyl-N'-phenyl-butyl-3-phenylureaNSC947911-butyl-3-phenyl-urea1-phenyl-3-butyl ureaUrea,n-butyl-n-phenyl-
Show more names
(butylamino)-N-benzamideN-Butyl-N'-phenylurea #SCHEMBL2816879SCHEMBL4063235SCHEMBL4604785SCHEMBL8666422SCHEMBL15064642DTXSID30953030
Database identifiers
- CAS
3083-88-3- PubChem CID
- 96940
- DTXSID
DTXSID30953030- EC Number
- 653-447-4
- Nikkaji
- J617.483C
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 165
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]
P264, P270, P301+P317, P330, 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. 4 (100%)
Suppliers
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Related reactions
2 records
Compound notes
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