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4-(4-chlorophenyl)-5,5-dimethyl-2-oxooxolane-3-carbonitrile

4-(4-chlorophenyl)-5,5-dimethyl-2-oxooxolane-3-carbonitrile structure

CAS No:
21863-85-4
Formula:
C13H12ClNO2
Chemical Name:
4-(4-chlorophenyl)-5,5-dimethyl-2-oxooxolane-3-carbonitrile
Synonyms:
4-(4-chlorophenyl)-5,5-dimethyl-2-oxotetrahydrofuran-3-carbonitrile;21863-85-4;NSC111317;DTXSID40296763;NSC-111317

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4-(4-chlorophenyl)-5,5-dimethyl-2-oxooxolane-3-carbonitrile Basic Attributes

Molecular Weight：

249.69 g/mol

Exact Mass：

249.0556563 g/mol

NSC Number：

111317

DSSTox ID：

DTXSID40296763

Characteristics

PSA：

50.1 Å²

Computed Properties

Molecular Weight:249.69
XLogP3:2.8
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:249.0556563
Monoisotopic Mass:249.0556563
Topological Polar Surface Area:50.1
Heavy Atom Count:17
Complexity:363
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(4-chlorophenyl)-5,5-dimethyl-2-oxooxolane-3-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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