1-(2-cyanoethyl)-1-oxidopyrrolidin-1-ium-2-carboxylic acid
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1-(2-cyanoethyl)-1-oxidopyrrolidin-1-ium-2-carboxylic acid
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CAS No:
36901-99-2
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Formula:
C8H12N2O3
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Chemical Name:
1-(2-cyanoethyl)-1-oxidopyrrolidin-1-ium-2-carboxylic acid
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Synonyms:
36901-99-2;2-CARBOXY-1-(2-CYANOETHYL)PYRROLIDIN-1-IUM-1-OLATE;36901-95-8;1-(2-cyanoethyl)pyrrolidine-2-carboxylic acid 1-oxide;NSC109548;L-Proline,1-(2-cyanoethyl)-, 1-oxide (9CI);DTXSID70296478;NSC-109548;DS-000115;CS-0040589;2-Carboxy-1-(2-cyanoethyl)pyrrolidine 1-oxide
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CAS No:
1-(2-cyanoethyl)-1-oxidopyrrolidin-1-ium-2-carboxylic acid Basic Attributes
184.19 g/mol
184.08479225 g/mol
109548
DTXSID70296478
Computed Properties
Molecular Weight:184.19
XLogP3:0.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:184.08479225
Monoisotopic Mass:184.08479225
Topological Polar Surface Area:79.2
Heavy Atom Count:13
Complexity:257
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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