chempirical

1,3-Diphenylurea

C13H12N2OCAS 102-07-8212.25 g/mol

Open in Covalent MOL file
OHNNH

Properties

Molecular formula
C13H12N2O
Molar mass
212.25 g/mol
Exact mass
212.0950 Da
Density
1.24 g/mL
Melting point
238 °C
Boiling point
262 °C
logP
3.34Crippen estimate
Polar surface area
44.6 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Identifiers

CAS number
102-07-8
SMILES
OC(=Nc1ccccc1)Nc1ccccc1
InChIKey
GWEHVDNNLFDJLR-UHFFFAOYSA-N
InChI
InChI=1S/C13H12N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)

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Type any one amount. The others follow from the molar mass and density.

Names and synonyms

11 names
  • Urea, N,N′-diphenyl-
  • Carbanilide
  • N,N′-Diphenylurea
  • s-Diphenylurea
  • Sym-Diphenylurea
  • N-Phenyl-N′-phenylurea
  • 1,3-Diphenylcarbamide
  • DPU
  • AD 30
  • NSC 227401
  • NSC 8485

Work with 1,3-Diphenylurea

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N,N′,N′′-Triphenylguanidine101-01-963 % similar 4-Phenylsemicarbazide537-47-359 % similar Forchlorfenuron68157-60-857 % similar Thiocarbanilide102-08-957 % similar Thidiazuron51707-55-253 % similar (1R,2R)-2-[[4′-[[(Phenylamino)carbonyl]amino][1,1′-biphenyl]-4-yl]carbonyl]cyclopentanecarboxylic acid959122-11-347 % similar Phenylurea64-10-847 % similar Imidocarb27885-92-344 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-(3-Aminophenyl)benzamide16091-26-2 N-(4-Aminophenyl)benzamide17625-83-1 p-Phenylbenzoic acid hydrazide18622-23-6 4-Methoxyazobenzene2396-60-3 3,4-Diaminobenzophenone39070-63-8 2-Amino-N-phenylbenzamide4424-17-3 Harmine442-51-3 3,3′-Diaminobenzophenone611-79-0

Elsewhere

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