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trideca-5,8-diyn-7-one

trideca-5,8-diyn-7-one structure

CAS No:
18621-56-2
Formula:
C13H18O
Chemical Name:
trideca-5,8-diyn-7-one
Synonyms:
5,8-Tridecadiyn-7-one;18621-56-2;trideca-5,8-diyn-7-one;BRN 1857058;NSC94549;Di(1-hexynyl) ketone;NCIOpen2_001312;SCHEMBL16594184;DTXSID50171870;ZINC1609741;NSC 94549;NSC-94549

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trideca-5,8-diyn-7-one Basic Attributes

Molecular Weight：

190.28 g/mol

Exact Mass：

190.135765193 g/mol

NSC Number：

94549

DSSTox ID：

DTXSID50171870

Characteristics

PSA：

17.1 Å²

Computed Properties

Molecular Weight:190.28
XLogP3:5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:190.135765193
Monoisotopic Mass:190.135765193
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:256
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of trideca-5,8-diyn-7-one

Basic Attributes
Characteristics
Computed Properties

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