Chlortoluron

C₁₀H₁₃ClN₂OCAS 15545-48-9212.68 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₃ClN₂O
Molar mass: 212.68 g/mol
Exact mass: 212.0716 Da
Density: 1.4 g/mL
Melting point: 147–148 °C
Water solubility: 70 mg/L (25 °C)
logP: 2.76Crippen estimate
Polar surface area: 35.8 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Warning

H351 Suspected of causing cancerCarcinogenicity
H361d *** Suspected of damaging the unborn childReproductive toxicity
H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
H410 Very toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 616-105-00-5), via PubChem.

Precautionary statements

P203, P273, P280, P318, P391, P405, P501

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 and density.

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 3-Chloro-4-methylphenyl isothiocyanate19241-37-346 % similar Chloro-p-xylene95-72-746 % similar 3-Chloro-4-methylbenzoic acid5162-82-343 % 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