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Dibenzylideneacetone

Dibenzylideneacetone structure

CAS No:
538-58-9
Formula:
C17H14O
Chemical Name:
Dibenzylideneacetone
Synonyms:
1,4-Pentadien-3-one,1,5-diphenyl-;3-Pentadienone,1,5-diphenyl-;1,5-Diphenyl-1,4-pentadien-3-one;Dibenzalacetone;Dibenzylideneacetone;Distyryl ketone;Styrol ketone;1,5-Diphenyl-3-pentadienone;Bis(2-phenylvinyl) ketone;Bis(2-phenylethenyl) ketone;1,5-Diphenyl-1,4-pentadienone;NSC 117234;NSC 623642;NSC 8103
Categories:
Catalyst and Auxiliary > Precious Metal Catalysts

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Description

yellow powder

Dibenzylideneacetone Basic Attributes

Molecular Weight：

234.29

Exact Mass：

234.29

EC Number：

609-096-4

UNII：

N4SH2VDI6Y

NSC Number：

117234|8103

DSSTox ID：

DTXSID0060224

Characteristics

PSA：

17.1

XLogP3：

4.1

Appearance：

yellow powder

Density：

1.1g/cm3

Melting Point：

113 °C (decomp)

Boiling Point：

400.7°C at 760 mmHg

Flash Point：

176.2ºC

Refractive Index：

1.649

Storage Conditions：

0-6ºC

Safety Information

wgk germany：

safety instructions：

S22-S24/25

Stability/Shelf Life：

Stable. Incompatible with strong oxidizing agents. Combustible.

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

Drug Information

MeSH Entry Terms：

dibenzalacetone

Dibenzylideneacetone Use and Manufacturing

Manufacturing Info：

1,4-Pentadien-3-one, 1,5-diphenyl-: ACTIVE

Computed Properties

Molecular Weight:234.29
XLogP3:4.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:234.104465066
Monoisotopic Mass:234.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:18
Complexity:272
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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