Fenvalerate


PubChem CID 3347
Molecular Formula C25H22ClNO3
Structure Compound Image
Synonyms
fenvalerate
51630-58-1
Phenvalerate
Pydrin
Sumicidin
Belmark
Tirade
Aqmatrine
Phenoxin
Agrofen
Ectrin
Fenaxin
Fenkem
Fenkill
Fenoxin
Fenval
Evercide 2362
Cyano(3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-3-methylbutanoate
S-5602
Asana
4-Chloro-alpha-(1-methylethyl)benzeneacetic acid cyano(3-phenoxyphenyl)methyl ester
alpha-Cyano-3-phenoxybenzyl 2-(4-chlorophenyl)isovalerate
CHEBI:5014
Z6MXZ39302
MFCD00055324
Furitrothion
Insectral
Sanmarton
Sumibac
Sumifleece
Sumifly
Sumipower
Sumitick
Sumkidin
Tribute
WL-43775
[cyano-(3-phenoxyphenyl)methyl] 2-(4-chlorophenyl)-3-methylbutanoate
alpha-Cyano-(3-phenoxyphenyl)methyl-4-chloro-alpha-(1-methylethyl)benzeneacetate
Benzeneacetic acid, 4-chloro-.alpha.-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester
Gold crest tribute
Sumicidin 20E
Caswell No. 077A
Fenvalerate [BSI:ISO]
[(S)-cyano-(3-phenoxyphenyl)methyl] (2R)-2-(4-chlorophenyl)-3-methylbutanoate
Fenvalerate .alpha.
cyano[3-(phenyloxy)phenyl]methyl 2-(4-chlorophenyl)-3-methylbutanoate
Sumicidin A .alpha.
Fenvalerate A .alpha.
Benzeneacetic acid, 4-chloro-.alpha.-(1-methylethyl)-, cyano (3-phenoxyphenyl)methyl ester,(S-(R*,R*))-
CCRIS 311
alpha-Cyano-3-phenoxybenzyl alpha-(4-chlorophenyl)isovalerate
WL 43775
HSDB 6640
EPA Shaughnessy Code: 109301
S 5602 A .alpha.
OMS-2000
Fenvalerate [INN:BAN]
EINECS 257-326-3
BRN 2025982
fenvaierate
SD 43775
UNII-Z6MXZ39302
AI3-29235
S 5602
(Cyano(3-phenoxyphenyl)methyl-4-chloro-alpha-(1-methylethyl)phenylacetate)
Fenvalerate solution
Acadrex (TN)
Fenvalerate (BAN)
(+-)-Fenvalerate
Fenvalerate 10 microg/mL in Isooctane
Fenvalerate 100 microg/mL in Isooctane
Fenvalerate, >=97%
alpha-Cyano-3-phenoxybenzyl-2-(4-chlorophenyl)-3-methylbutyrate
FENVALERATE [MI]
alpha-Cyano-3-phenoxybenzyl alpha-isopropyl-4-chlorophenylacetate
FENVALERATE [ISO]
Fenvalerate-(phenoxy-d5)
(+)-alpha-Cyano-3-phenoxybenzyl-(+)-alpha-(4-chlorophenyl)isovalerate
FENVALERATE [HSDB]
FENVALERATE [IARC]
(RS)-alpha-Cyano-3-phenoxybenzyl (RS)-2-(4-chlorophenyl)-3-methylbutyrate
Cyano(3-phenoxyphenyl)methyl 4-chloro-alpha-(1-methylethyl)benzeneacetate
FENVALERATE [MART.]
SCHEMBL26911
(S)-alpha-Cyano-3-phenoxybenzyl(S)-2-(4-chlorophenyl)isovalerate
Cyano(3-phenoxyphenyl)methyl 2-(4-chlorophenyl)-3-methylbutanoate #
BMK1-H10
CHEMBL492491
(S)-.alpha.-Cyano-3-phenoxybenzyl(S)-2-(4-chlorophenyl)-3-methylbutyrate
NIOSH/CY1576360
Cyano (3-phenoxybenzyl)-2-(4-chlorophenyl)-3-methylbutyrate
DTXSID101017940
alpha-Cyano-3-phenoxybenzyl alpha-(4-chlorophenyl)-iso-valerate
Cyano(3-phenoxybenzyl)methyl 2-(4-chlorophenyl)-3-methylbutyrate
HY-B2006
HSCI1_000043
(RS)-alpha-Cyano-3-phenoxybenzyl (RS)-2-(4-chloro-phenyl)-3-methylbutyrate
AKOS015904814
Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester
NCGC00163508-01
NCGC00163508-02
NCGC00163508-03
AC-22281
AS-49365
1ST20226-1000B
CS-0014107
CY15763600
NS00099445
Fenvalerate Solution in Acetone, 1000?g/mL
D07952
Fenvalerate, PESTANAL(R), analytical standard
H11436
EN300-1717625
Q412010
W-111022
Fenvalerate, certified reference material, TraceCERT(R)
a-Cyano-3-phenoxybenzyl 2-(4-chlorophenyl)-3-methylbutyrate
alpha-cyano-m-phenoxybenzyl 2-(p-chlorophenyl)-3-methylbutyrate
alpha-cyano-3-phenoxy-benzyl 2-(p-chlorophenyl)-2-isopropyl-acetate
alpha-cyano-3-phenoxybenzyl 2-(4-chlorophenyl)-3-methylbutanoate
alpha-cyano-3-phenoxybenzyl 2-(4-chlorophenyl)-3-methylbutyrate
Cyano(3-phenoxyphenyl)methyl 4-chloro-a-(1-methylethyl)benzeneacetate, 9CI
(+-)-4-Chloro-alpha-(1-methylethyl)benzeneacetic acid cyano(3-phenoxyphenyl)methyl ester
(RS)-.ALPHA.-CYANO-3-PHENOXYBENZYL (RS)-2-(4-CHLORO-PHENYL)-3-METHYLBUTYRATE
CYANO(3-PHENOXYPHENYL)METHYL 4-CHLORO-.ALPHA.-(1-METHYLETHYL)BENZENEACETATE
Cyano(3-phenoxyphenyl)methyl ester, 4-chloro-alpha-(1-methylethyl)benzeneacetic acid
(.ALPHA.RS)-.ALPHA.-CYANO-3-PHENOXYBENZYL (2RS)-2-(4-CHLOROPHENYL)-3-METHYLBUTYRATE
Benzeneacetic acid, 4-chloro-alpha-(1-methylethyl)-, cyano(3-phenoxyphenyl)methyl ester, (+-)-

Computed Descriptors


IUPAC Name [cyano-(3-phenoxyphenyl)methyl] 2-(4-chlorophenyl)-3-methylbutanoate
SMILES CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3
Canonical SMILES CC(C)C(C1=CC=C(C=C1)Cl)C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3
InChI InChI=1S/C25H22ClNO3/c1-17(2)24(18-11-13-20(26)14-12-18)25(28)30-23(16-27)19-7-6-10-22(15-19)29-21-8-4-3-5-9-21/h3-15,17,23-24H,1-2H3
InChIKey NYPJDWWKZLNGGM-UHFFFAOYSA-N

Computed Properties

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Molecular Weight 419.9 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 8
Exact Mass 419.129
Monoisotopic Mass 419.129
Topological Polar Surface Area 59.3
Heavy Atom Count 30
Formal Charge 0
Complexity 586
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1

Annotation

  • D004791 - Enzyme Inhibitors|D010575 - Pesticides
  • D007306 - Insecticides
  • D011722 - Pyrethrins|D016573 - Agrochemicals
  • 21 pairs of Verified P450 and Fenvalerate


    Insect Gene Symbol Validation Reference
    Helicoverpa armigera CYP337B3V2 X
    Helicoverpa armigera CYP6AE11 X
    Helicoverpa armigera CYP6AE12 X
    Helicoverpa armigera CYP6AE14 X
    Helicoverpa armigera CYP6AE15 X
    Helicoverpa armigera CYP6AE16 X
    Helicoverpa armigera CYP6AE17 X
    Helicoverpa armigera CYP6AE18 X
    Helicoverpa armigera CYP6AE19 X
    Helicoverpa armigera CYP6AE24 X
    Helicoverpa armigera CYP6B7 R
    Helicoverpa armigera CYP6B7 Y
    Helicoverpa armigera CYP6B7 Y
    Laodelphax striatellus CYP301B1 D,X
    Laodelphax striatellus CYP4FB1 D,X
    Locusta migratoria CYP6HL1 R
    Locusta migratoria CYP6HN1 R
    Spodoptera exigua CYP9A105 R
    Spodoptera litura CYP6AE43 R
    Spodoptera litura CYP6AE48 R
    Trichoplusia ni CYP4L4 X