Basic information
- CAS
42865-77-0- Standard SMILES
CC(=O)c1cccc(NC(=O)Nc2ccccc2)c1- InChIKey
RADYAVHHYJPIBL-UHFFFAOYSA-N- Molecular formula
- C15H14N2O2
- Average molar mass
- 254.28 g/mol
- Monoisotopic mass
- 254.10552769
Names & identifiers
- Preferred name
- N-(3-Acetylphenyl)-N'-phenylurea
- IUPAC
- 1-(3-acetylphenyl)-3-phenylurea
- English name
- 1-(3-Acetylphenyl)-3-phenylurea
- Molecular formula
- C15H14N2O2
- Molecular weight
- 254.28
Names & synonyms
42865-77-0N-(3-acetylphenyl)-N'-phenylureaDTXSID30304169RefChem:361215DTXCID502553011-(3-acetylphenyl)-3-phenylurea3-(3-acetylphenyl)-1-phenylureaMFCD00171015N-(3-acetylphenyl)(phenylamino)carboxamideNSC164417Cambridge id 5147706CBDivE_004214
Show more names
AURORA 287CHEMBRDG-BB 5147706Urea, N-(3-acetylphenyl)-N'-phenyl-
MLS001194842SCHEMBL4918597CHEMBL1602689HMS2854B071-(3-acetylphenyl)-3-phenyl-ureaSBB062382STK062503AKOS000192909
Database identifiers
- CAS
42865-77-0- PubChem CID
- 295256
- DTXSID
DTXSID30304169- ChEMBL
CHEMBL1602689
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 324
Experimental & physicochemical properties
Solubility10.5 [ug/mL] (The mean of the results at pH 7.4)
Physicochemical properties
- Boiling point
- 334.8 · 334.8±25.0 °C(Predicted)
- Density
- 1.262 · 1.262±0.06 g/cm3(Predicted)
- pka
- 14.05 · 14.05±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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