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1,5-Diphenyl-1,4-pentadiyn-3-one

1,5-Diphenyl-1,4-pentadiyn-3-one structure

CAS No:
15814-30-9
Formula:
C17H10O
Chemical Name:
1,5-Diphenyl-1,4-pentadiyn-3-one
Synonyms:
1,4-Pentadiyn-3-one,1,5-diphenyl-;1,5-Diphenyl-1,4-pentadiyn-3-one;Bis(phenylethynyl) ketone;1,5-Bis(phenyl)penta-1,4-diyn-3-one

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1,5-Diphenyl-1,4-pentadiyn-3-one Basic Attributes

Molecular Weight：

230.26100

Exact Mass：

230.26

DSSTox ID：

DTXSID20166379

Characteristics

PSA：

17.07000

XLogP3：

2.65890

Density：

1.17g/cm3

Melting Point：

64-65 °C

Boiling Point：

376.5ºC

Flash Point：

161.4ºC

Refractive Index：

1.641

Vapor Pressure：

7.2E-06mmHg at 25°C

Drug Information

MeSH Entry Terms：

1,5-diphenyl-1,4-pentadiyn-3-one

Computed Properties

Molecular Weight:230.26
XLogP3:5.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:230.073164938
Monoisotopic Mass:230.073164938
Topological Polar Surface Area:17.1
Heavy Atom Count:18
Complexity:368
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,5-Diphenyl-1,4-pentadiyn-3-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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