chempirical

Chlortoluron

C10H13ClN2OCAS 15545-48-9212.68 g/mol

Open in Covalent MOL file
NHONCl
Aryl halide

Properties

Molecular formula
C10H13ClN2O
Molar mass
212.68 g/mol
Exact mass
212.0716 Da
Melting point
147–148 °C
logP
2.76Crippen estimate
Polar surface area
35.8 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
15545-48-9
SMILES
Cc1ccc(N=C(O)N(C)C)cc1Cl
InChIKey
JXCGFZXSOMJFOA-UHFFFAOYSA-N
InChI
InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)

Weigh it out

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

Names and synonyms

26 names · show all
  • Urea, N′-(3-chloro-4-methylphenyl)-N,N-dimethyl-
  • Urea, 3-(3-chloro-p-tolyl)-1,1-dimethyl-
  • N′-(3-Chloro-4-methylphenyl)-N,N-dimethylurea
  • Chlorotoluron
  • 1-(3-Chloro-4-methylphenyl)-3,3-dimethylurea
  • N-(3-Chloro-4-methylphenyl)-N′,N′-dimethylurea
  • Dicuran
  • 1-(3-Chloro-4-methyl)-3,3-dimethylurea
  • 3-(3-Chloro-p-tolyl)-1,1-dimethylurea
  • N,N-Dimethyl-N′-(3-chloro-4-methylphenyl)urea
  • CGA 15646
  • Syncuran 80DP
  • Syncuran
  • N-(3-Chloro-4-tolyl)-N′,N′-dimethylurea
  • Lentipur forte
  • Tolurex
  • Dicuran 500FL
  • C 2242
  • 1,1-Dimethyl-3-(3-chloro-4-methylphenyl)urea
  • Lentipur flo
  • Lentipur
  • Lentipur 500SC
  • Tolurgan
  • Klortosan
  • 3-(3-Chloro-4-methylphenyl)-1,1-dimethylurea
  • Shvat SC

Work with Chlortoluron

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Dcmu330-54-174 % similar Linuron330-55-250 % similar Fenuron101-42-849 % similar Fluometuron2164-17-248 % similar 3-Chloro-4-methylphenyl isocyanate28479-22-348 % similar Chloro-P-xylene95-72-746 % similar 3-Chloro-4-methylbenzoic acid5162-82-343 % similar 3-Chloro-4-methylphenol615-62-342 % similar

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

Same formula

Serotonin hydrochloride153-98-0 3-Chloro-4-morpholinoaniline55048-24-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia