N-(3-Phenylpropyl)urea
Basic information
- CAS
25017-27-0- Standard SMILES
NC(=O)NCCCc1ccccc1- InChIKey
YDORGPSKSSWFBX-UHFFFAOYSA-N- Molecular formula
- C10H14N2O
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.11061307
Names & identifiers
- Preferred name
- N-(3-Phenylpropyl)urea
- IUPAC
- 3-phenylpropylurea
- English name
- (3-phenylpropyl)urea
- Molecular formula
- C10H14N2O
- Molecular weight
- 178.23
Names & synonyms
25017-27-0Urea, (3-phenylpropyl)-N-(3-Phenylpropyl)ureaDTXSID30179718RefChem:1091185DTXCID90102209(3-Phenylpropyl)urea3-phenylpropylurea1-(3-phenylpropyl)ureaBRN 28376154-12-00-02628 (Beilstein Handbook Reference)SCHEMBL1953254
Show more names
Urea, N-(3-phenylpropyl)-
SCHEMBL5840065ABA01727AKOS009095989EN300-68449G34115Z198194892
Database identifiers
- CAS
25017-27-0- PubChem CID
- 212818
- DTXSID
DTXSID30179718- EC Number
- 186-733-8
- Nikkaji
- J1.195.509F
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 153
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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