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Flutriafol

Flutriafol structure

CAS No:
76674-21-0
Formula:
C16H13F2N3O
Chemical Name:
Flutriafol
Synonyms:
1H-1,2,4-Triazole-1-ethanol,α-(2-fluorophenyl)-α-(4-fluorophenyl)-;α-(2-Fluorophenyl)-α-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol;Flutriafol;R 152450;PP 450-5;PP 450;Impact;Impact (fungicide);Sinker;87676-93-5;1135441-08-5
Categories:
Agrochemicals > Fungicides

Description

solid

1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol is a tertiary alcohol that is ethanol in which one of the hydrogens at position 1 is replaced by an p-fluorophenyl group, the other hydrogen at position 1 is replaced by a p-fluorophenyl group, and one of the hydrogens at position 2 is replaced by a 1H-1,2,4-triazol-1-yl group. It is a member of triazoles, a tertiary alcohol and a member of monofluorobenzenes.

Flutriafol Basic Attributes

Molecular Weight：

301.29100

Exact Mass：

301.29

EC Number：

616-367-0

DSSTox ID：

DTXSID8040727

HScode：

2933990015

Characteristics

PSA：

50.94000

XLogP3：

2.49240

Appearance：

solid

Density：

1.29 g/cm3

Melting Point：

130 °C

Boiling Point：

506.5ºC at 760 mmHg

Flash Point：

260.1ºC

Refractive Index：

1.6

Water Solubility：

130 mg l -1 (pH 7,20 °C)

Storage Conditions：

0-6ºC

Vapor Pressure：

7.1 x l0 -9 Pa (20 °C)

Toxicity：

LD50 male, female rats (mg/kg): 1140, 1480 orally; rats, rabbits: >1000, >2000 percutaneously (Skidmore)

Collision Cross Section：

163.97 Å² [M+H]+ [CCS Type: TW]|170.23 Å² [M-H]-

Safety Information

Transport codes：

UN 1648 3/PG 2

wgk germany：

hazard class code：

R22

safety instructions：

S22-S24/25

RTECS Number：

XZ4825000

Marks：

Stability/Shelf Life：

Stable. Incompatible with strong oxidizing agents.

Precautionary statement(s)：

P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P391, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P391, and P501|Aggregated GHS information provided by 294 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Mobility：

75.86 L/kg

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：

(RS)-2,4'-difluoro-alpha-(1H-1,2,4-triazol-1-ylmethyl)benzhydryl alcohol

Flutriafol Use and Manufacturing

Uses

Flutriafol is a systemic fungicide of the triazole class. Flutriafol has broad spectrum fungicidal activity and is used to control effectively cereal powdery mildew, cloud disease, leaf spot disease and rust disease.

Use Classification：

Agrochemicals -> Fungicides

Computed Properties

Molecular Weight:301.29
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:301.10266837
Monoisotopic Mass:301.10266837
Topological Polar Surface Area:50.9
Heavy Atom Count:22
Complexity:365
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Downstream Products

2-Fluorobenzoic acid

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