2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid
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![2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/792d41b2aedd4fa4a53a99df2460bc8a.png "2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid")
2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid
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CAS No:
70628-36-3
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Formula:
C11H13NO3
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Chemical Name:
2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid
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Synonyms:
Acetic acid,2-[(1-methylethyl)phenylamino]-2-oxo-;Acetic acid,[(1-methylethyl)phenylamino]oxo-;2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid;[Phenyl(propan-2-yl)carbamoyl]formic acid
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CAS No:
Description
ChEBI: A monocarboxylic acid that is oxoacetic acid substituted by a phenyl(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide propachlor.
Propachlor OXA is a monocarboxylic acid that is oxoacetic acid substituted by a phenyl(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide propachlor. It has a role as a marine xenobiotic metabolite. It is an anilide and a monocarboxylic acid.
Safety Information
3
43
36/37
Xi
P261, P272, P280, P302+P352, P321, P333+P313, P363, P501
H317
|Warning|H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]|P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.
2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid Use and Manufacturing
Pesticides -> Herbicides -> Amide herbicides -> Anilide herbicides -> Chloroacetanilide herbicides -> Transformation products
Propachlor OXA is a known environmental transformation product of Propachlor.
Computed Properties
Molecular Weight:207.23
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:207.08954328
Monoisotopic Mass:207.08954328
Topological Polar Surface Area:57.6
Heavy Atom Count:15
Complexity:244
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Latest News on 2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid
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2-[(1-Methylethyl)phenylamino]-2-oxoacetic acid
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