4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one
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![4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/dbf203a468314436a7661823fbd94393.png "4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one")
4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one
structure -
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CAS No:
148476-30-6
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Formula:
C17H20O3
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Chemical Name:
4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one
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Synonyms:
1-Oxaspiro[4.4]non-3-en-2-one,4-hydroxy-3-(2,4,6-trimethylphenyl)-;4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one;3-Mesityl-2-oxo-1-oxaspiro[4.4]non-3-en-4-ol
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CAS No:
4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one Basic Attributes
272.344
272.34
604-634-4
9H0TR7Y8SF
DTXSID50716240
Characteristics
46.5
3.75050
1.20±0.1 g/cm3(Predicted)
approximate 253℃ (dec.)
478.9±45.0 °C(Predicted)
203.8ºC
1.592
5.56E-10mmHg at 25°C
Safety Information
UN 3077 9 / PGIII
2
52/53
61
P273
H411
|H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 194 companies from 1 notifications to the ECHA C&L Inventory.
4-Hydroxy-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-2-one Use and Manufacturing
3-Mesityl-2-oxo-1-oxaspiro[4.4]non-3-en-4-ol, is the metabolite of Spiromesifen, which is a Spirocyclic Tetronic Acid, environmentally friendly and novel structural pesticide.
Computed Properties
Molecular Weight:272.34
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:272.14124450
Monoisotopic Mass:272.14124450
Topological Polar Surface Area:46.5
Heavy Atom Count:20
Complexity:433
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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