3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester
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3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester
structure -
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CAS No:
163520-33-0
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Formula:
C18H17NO3
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Chemical Name:
3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester
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Synonyms:
3-Isoxazolecarboxylic acid,4,5-dihydro-5,5-diphenyl-,ethyl ester;Isoxadifen-ethyl;HOE 122006;AE-F 122006;Isoxadifen ethyl ester
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CAS No:
Description
ChEBI: An isoxazoline that is the ethyl ester of isoxadifen. It is used as a herbicide safener, especially in conjunction with the herbicides fenoxaprop-P-ethyl and iodosulfuron-methyl-sodium. It is not approved for use within the European Union.
DryPowder; OtherSolid
Isoxadifen-ethyl is an isoxazoline that is the ethyl ester of isoxadifen. It is used as a herbicide safener, especially in conjunction with the herbicides fenoxaprop-P-ethyl and iodosulfuron-methyl-sodium. It is not approved for use within the European Union. It has a role as a herbicide safener and an agrochemical. It is an ethyl ester and an isoxazoline. It derives from an isoxadifen.
3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester Basic Attributes
295.33
295.33
443-870-0
71LF32W32E
DTXSID7040360
2934999050
Characteristics
47.9
3.10
1.15±0.1 g/cm3 (20 ºC 760 Torr)
87-88 °C @ Solvent: Diethyl ether
407.7±55.0 °C(Predicted)
166.8±25.9 °C
1.577
0-6°C
7.43E-07mmHg at 25°C
Safety Information
III
9
UN30779/PG3
3
22-43-50-50/53
36/37-61-60-22
NY2390000
Xn,N
P273-P280-P501
H302-H317-H410
|Warning|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P273, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, P391, and P501|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|Aggregated GHS information provided by 19 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Aggregated GHS information provided by 207 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester Use and Manufacturing
Agricultural chemicals (non-pesticidal)
Non-TSCA use
Pesticide, fertilizer, and other agricultural chemical manufacturing|3-Isoxazolecarboxylic acid, 4,5-dihydro-5,5-diphenyl-, ethyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:295.3
XLogP3:3.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:295.12084340
Monoisotopic Mass:295.12084340
Topological Polar Surface Area:47.9
Heavy Atom Count:22
Complexity:402
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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