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2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE

2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE structure

CAS No:
103049-97-4
Formula:
C26H38O2S2
Chemical Name:
2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE
Synonyms:
2,3-Bis(n-octylthio)-1,4-naphthalenedione;2,3-bis(octylsulfanyl)naphthalene-1,4-dione;CTK8E3476;DTXSID10662996;7729AC;AKOS015839887;ZINC100314024;1,4-Naphthalenedione,2,3-bis(octylthio)-;FT-0677486

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2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE Basic Attributes

Molecular Weight：

446.71

Exact Mass：

446.23100

DSSTox ID：

DTXSID10662996

HScode：

2930909090

Characteristics

PSA：

84.7

XLogP3：

8.46460

Density：

1.08±0.1 g/cm3(Predicted)

Melting Point：

58 °C

Boiling Point：

541.5±50.0 °C(Predicted)

Flash Point：

209.6ºC

Refractive Index：

1.559

Vapor Pressure：

8.63E-12mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

Marks：

Computed Properties

Molecular Weight:446.7
XLogP3:9.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:16
Exact Mass:446.23132280
Monoisotopic Mass:446.23132280
Topological Polar Surface Area:84.7
Heavy Atom Count:30
Complexity:507
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE

Basic Attributes
Characteristics
Safety Information
Computed Properties

2,3-BIS(N-OCTYLTHIO)-1,4-NAPHTHALENEDIONE

SDS

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