Fenoprop

C₉H₇Cl₃O₃CAS 93-72-1269.50 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid Ether

Properties

Molecular formula: C₉H₇Cl₃O₃
Molar mass: 269.50 g/mol
Exact mass: 267.9461 Da
Density: 1.2085 g/mL (at 20 °C)
Melting point: 181.6 °C
pKa: 2.84
Water solubility: 140 mg/L (25 °C)
logP: 3.50Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Hazards

Warning

H302 Harmful if swallowedAcute toxicity, oral
H315 Causes skin irritationSkin corrosion/irritation
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 607-047-00-1), via PubChem.

Precautionary statements

P264, P270, P273, P280, P301+P317, P302+P352, P321, P330, P332+P317, P362+P364, P391, P501

Identifiers

CAS number

93-72-1

SMILES

CC(Oc1cc(Cl)c(Cl)cc1Cl)C(=O)O

InChIKey

ZLSWBLPERHFHIS-UHFFFAOYSA-N

InChI

InChI=1S/C9H7Cl3O3/c1-4(9(13)14)15-8-3-6(11)5(10)2-7(8)12/h2-4H,1H3,(H,13,14)

Weigh it out

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

Names and synonyms

22 names · show all

Propanoic acid, 2-(2,4,5-trichlorophenoxy)-
Propionic acid, 2-(2,4,5-trichlorophenoxy)-
2-(2,4,5-Trichlorophenoxy)propanoic acid
Color-set
Fruitone T
Kurosal G
Silvex
Silvi-rhap
Sta-fast
2-(2,4,5-Trichlorophenoxy)propionic acid
2,4,5-TP
2,4,5-Trichlorophenoxypropionic acid
α-(2,4,5-Trichlorophenoxy)propionic acid
Fenormone
2,4,5-TCPP
(±)-2-(2,4,5-Trichlorophenoxy)propionic acid
(±)-Fenoprop
(±)-Silvex
2,4,5-Trichlorophenoxypropanoic acid
2,4,5-TCPPA
Phenoprop
2-(2′,4′,5′-Trichloro-phenoxy)-propionic acid

Work with Fenoprop

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

2-(2-Chlorophenoxy)propionic acid25140-86-770 % similar Dichlorprop120-36-569 % similar Mecoprop7085-19-056 % similar Mecoprop93-65-256 % similar 2-(4-Chlorophenoxy)propionic acid3307-39-953 % similar (±)-2-(3-Chlorophenoxy)propionic acid101-10-052 % similar Clofop26129-32-849 % similar DL-2-Phenoxypropionic acid940-31-849 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia