chempirical

Chlorempenthrin

C16H20Cl2O2CAS 54407-47-5315.23 g/mol

Open in Covalent MOL file
OOClCl
AlkeneAlkyneEsterVinyl halide

Properties

Molecular formula
C16H20Cl2O2
Molar mass
315.23 g/mol
Exact mass
314.0840 Da
logP
4.48Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
5
Double bonds
EE/Z, in SMILES order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
54407-47-5
SMILES
CC/C=C(\C)/C(C#C)OC(=O)C1C(C1(C)C)C=C(Cl)Cl
InChIKey
XCUGQTFVQHTFPD-CSKARUKUSA-N
InChI
InChI=1S/C16H20Cl2O2/c1-6-8-10(3)12(7-2)20-15(19)14-11(9-13(17)18)16(14,4)5/h2,8-9,11-12,14H,6H2,1,3-5H3/b10-8+

Weigh it out

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Work with Chlorempenthrin

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

Empenthrin54406-48-380 % similar 3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarbonyl chloride52314-67-741 % similar Renofluthrin352271-52-441 % similar Transfluthrin118712-89-340 % similar (1R,3S)-3-(2,2-Dichloroethenyl)-2,2-dimethylcyclopropanecarboxylic acid55701-03-640 % similar Permethric acid55701-05-840 % similar Cypermethrin52315-07-839 % similar Alpha-cypermethrin65731-84-239 % similar

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

Elsewhere

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