Triflumuron

C₁₅H₁₀ClF₃N₂O₃CAS 64628-44-0358.70 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide Ether

Properties

Molecular formula: C₁₅H₁₀ClF₃N₂O₃
Molar mass: 358.70 g/mol
Exact mass: 358.0332 Da
Melting point: 195 °C
logP: 4.78Crippen estimate
Polar surface area: 70.9 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Hazards

Danger

H330 Fatal if inhaled56.5% of notifiers
H400 Very toxic to aquatic life43.5% of notifiers
H410 Very toxic to aquatic life with long lasting effects43.5% of notifiers

Aggregated from 69 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P271, P273, P284, P304+P340, P316, P320, P391, P403+P233, P405, P501

Identifiers

CAS number

64628-44-0

SMILES

O=C(N=C(O)c1ccccc1Cl)Nc1ccc(OC(F)(F)F)cc1

InChIKey

XAIPTRIXGHTTNT-UHFFFAOYSA-N

InChI

InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)

Weigh it out

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Names and synonyms

14 names · show all

Benzamide, 2-chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]-
2-Chloro-N-[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]benzamide
BAY-SIR 8514
SIR 8514
N-(2-Chlorobenzoyl)-N′-[4-(trifluoromethoxy)phenyl]urea
Trifluron
BAY-Vi 7533
Alsystin
Alsystine
OMS 2015
Starycide
Baycidal
1-(2-Chlorobenzoyl)-3-[4-(trifluoromethoxy)phenyl]urea
Baytsidal

Work with Triflumuron

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

Diflubenzuron35367-38-545 % similar 2-Chloro-N-[4-(trifluoromethoxy)phenyl]acetamide161290-85-344 % similar Lufenuron103055-07-841 % similar 2-Chlorobenzoic acid hydrazide5814-05-138 % similar 1-(4-(Trifluoromethoxy)phenyl)-2-thiourea142229-74-138 % similar 4-(Trifluoromethoxy)benzoic acid330-12-138 % similar 3-(Trifluoromethoxy)benzoic acid1014-81-938 % similar 2-Chloro-5-(trifluoromethoxy)phenylboronic acid1022922-16-238 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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