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4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile

4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile structure

CAS No:
7460-35-7
Formula:
C13H12N2O2
Chemical Name:
4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile
Synonyms:
7460-35-7;NSC55171;4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile;DTXSID00288280;NSC-55171;DS-005145;4,5-dioxo-1-phenethyl-pyrrolidine-3-carbonitrile

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4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile Basic Attributes

Molecular Weight：

228.25 g/mol

Exact Mass：

228.089877630 g/mol

NSC Number：

55171

DSSTox ID：

DTXSID00288280

Characteristics

PSA：

61.2 Å²

Computed Properties

Molecular Weight:228.25
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:228.089877630
Monoisotopic Mass:228.089877630
Topological Polar Surface Area:61.2
Heavy Atom Count:17
Complexity:363
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,5-dioxo-1-(2-phenylethyl)pyrrolidine-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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