Theta-cypermethrin
Properties
- Molecular formula
- C22H19Cl2NO3
- Molar mass
- 416.30 g/mol
- Exact mass
- 415.0742 Da
- logP
- 6.18Crippen estimate
- Polar surface area
- 59.3 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 6
- Stereocentres
- R, S, Rin SMILES atom 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
71697-59-1SMILES
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)O[C@@H](C#N)c1cccc(Oc2ccccc2)c1InChIKey
KAATUXNTWXVJKI-AXPCPNSHNA-NInChI
InChI=1/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18-,20+/s2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (R)-cyano(3-phenoxyphenyl)methyl ester, (1S,3R)-rel-
- Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester, [1α(S*),3β]-(±)-
- NRDC 159
- Transmix
Work with Theta-cypermethrin
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Cyphenothrin39515-40-781 % similar
Deltamethrin52918-63-580 % similar
Cyhalothrin68085-85-879 % similar
Cyhalothrin91465-08-679 % similar
Cyfluthrin68359-37-575 % similar
Fenpropathrin39515-41-864 % similar
Fenpropathrin64257-84-764 % similar
Permethrin52645-53-162 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds