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Picoxystrobin

Picoxystrobin structure

CAS No:
117428-22-5
Formula:
C18H16F3NO4
Chemical Name:
Picoxystrobin
Synonyms:
Benzeneacetic acid,α-(methoxymethylene)-2-[[[6-(trifluoromethyl)-2-pyridinyl]oxy]methyl]-,methyl ester,(αE)-;Benzeneacetic acid,α-(methoxymethylene)-2-[[[6-(trifluoromethyl)-2-pyridinyl]oxy]methyl]-,methyl ester,(E)-;Picoxystrobin;ZEN 90160;Acanto;Acapela;Aproach
Categories:
Active Pharmaceutical Ingredients > Antibiotics

Description

ChEBI: An enoate ester that is the methyl ester of (2E)-3-methoxy-2-[2-({[6-(trifluoromethyl)pyridin-2-yl]oxy}methyl)phenyl]prop-2-enoic acid. A cereal fungicide used to control a wide range of diseases including brown rust, tan spot, powdery mi dew and net blotch.Picoxystrobin, as a kind of Strobilurin analogues, is a kind of fungicide. It can be used for control of many kinds of fungal diseases such as yellow, brown, crown rusts, powdery mildew, and sooty mold, net and leaf blotch as well a

Picoxystrobin is an enoate ester that is the methyl ester of (2E)-3-methoxy-2-[2-({[6-(trifluoromethyl)pyridin-2-yl]oxy}methyl)phenyl]prop-2-enoic acid. A cereal fungicide used to control a wide range of diseases including brown rust, tan spot, powdery mildew and net blotch. It has a role as a mitochondrial cytochrome-bc1 complex inhibitor and an antifungal agrochemical. It is an aromatic ether, an enoate ester, an enol ether, an organofluorine compound, a member of pyridines and a methoxyacrylate strobilurin antifungal agent.

Picoxystrobin Basic Attributes

Molecular Weight：

367.32

Exact Mass：

367.32

EC Number：

1806241-263-5

UNII：

62DH7GEL1P

DSSTox ID：

DTXSID9047542

HScode：

29333990

Characteristics

PSA：

57.6

XLogP3：

4.48

Density：

d20 1.4

Melting Point：

68-69 °C

Boiling Point：

453.1±45.0 °C(Predicted)

Flash Point：

227.9±28.7 °C

Refractive Index：

1.522

Vapor Pressure：

2.12E-08mmHg at 25°C

Toxicity：

MLD in rats (mg/kg): >5000 orally; >2000 dermally; MLC in rats (mg/l): 2.12 by inhalation (Godwin)

Collision Cross Section：

177.5 Å² [M+H]+ [CCS Type: TW]

Safety Information

Transport codes：

UN 3077

wgk germany：

hazard class code：

50/53

safety instructions：

60-61

Marks：

Precautionary statement(s)：

P273-P305 + P351 + P338

Hazard Statements：

H319-H332-H400

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P261, P264, P271, P273, P280, P304+P312, P304+P340, P305+P351+P338, P312, P337+P313, P391, and P501|Aggregated GHS information provided by 228 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Chemicals that kill or inhibit the growth of fungi in agricultural applications, on wood, plastics, or other materials, in swimming pools, etc. (See all compounds classified as Fungicides, Industrial.)

MeSH Entry Terms：

methyl (2E)-3-methoxy-2-(2-(6-(trifluoromethyl)-2-pyridyloxymethyl)phenyl)acrylate

Picoxystrobin Use and Manufacturing

Uses

Agricultural fungicide.

Use Classification：

Agrochemicals -> Fungicides|Pharmaceuticals|Fungicides|Environmental transformation -> Pesticides (parent, predecessor)

Agrochemical：

Picoxystrobin has known environmental transformation products that include (2E)-3-methoxy-2-(2-(((6-(trifluoromethyl)pyridin-2-yl)oxy)methyl)phenyl)acrylic acid, 2-methoxy-6-(trifluoromethyl)pyridine, and 6-(trifluoromethyl)pyridin-2(1H)-one.|Picoxystrobin has known environmental transformation products that include 2-({[6-(Trifluoromethyl)-2-pyridinyl]oxy}methyl)benzoic acid, 2-Methoxy-6-(trifluoromethyl)pyridine, 6-(Trifluoromethyl)pyridin-2-ol, Phthalic acid, Picoxystrobin TP 12, Picoxystrobin TP 13, Picoxystrobin TP 2, and Picoxystrobin TP 4.

Computed Properties

Molecular Weight:367.3
XLogP3:3.6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:7
Exact Mass:367.10314248
Monoisotopic Mass:367.10314248
Topological Polar Surface Area:57.6
Heavy Atom Count:26
Complexity:495
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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