1-(3-Methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid
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1-(3-Methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid
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CAS No:
618070-31-8
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Formula:
C12H13NO3
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Chemical Name:
1-(3-Methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid
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Synonyms:
3-Pyrrolidinecarboxylic acid,1-(3-methylphenyl)-2-oxo-;1-(3-Methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid;2-Oxo-1-m-tolylpyrrolidine-3-carboxylic acid
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CAS No:
1-(3-Methylphenyl)-2-oxo-3-pyrrolidinecarboxylic acid Basic Attributes
219.23700
219.24
DTXSID20404440
2933990090
Safety Information
UN 2811 6.1/PG 3
R22
Xn
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P310, P302+P352, P321, P330, P333+P313, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:219.24
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:219.08954328
Monoisotopic Mass:219.08954328
Topological Polar Surface Area:57.6
Heavy Atom Count:16
Complexity:303
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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