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2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile

2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile structure

CAS No:
17005-27-5
Formula:
C14H16ClNO3
Chemical Name:
2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile
Synonyms:
17005-27-5;2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile;NSC101195;NCIOpen2_006854;DTXSID90295327;NSC-101195

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2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile Basic Attributes

Molecular Weight：

281.73 g/mol

Exact Mass：

281.0818711 g/mol

NSC Number：

101195

DSSTox ID：

DTXSID90295327

Characteristics

PSA：

59.3 Å²

Computed Properties

Molecular Weight:281.73
XLogP3:2.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:281.0818711
Monoisotopic Mass:281.0818711
Topological Polar Surface Area:59.3
Heavy Atom Count:19
Complexity:325
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-chlorophenyl)-4,4-diethoxy-3-oxobutanenitrile

Basic Attributes
Characteristics
Computed Properties

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