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2-phenylsulfanylcyclohexa-2,5-diene-1,4-dione

2-phenylsulfanylcyclohexa-2,5-diene-1,4-dione structure

CAS No:
18232-03-6
Formula:
C12H8O2S
Chemical Name:
2-phenylsulfanylcyclohexa-2,5-diene-1,4-dione
Synonyms:
p-Benzoquinone,2-(phenylthio); phenylsulfanyl-[1,4]benzoquinone; 2,4-dione,2-(phenylthio); Phenylthiobenzoquinone; 2-phenylthio[1,4]benzoquinone; Phenylmercapto-[1,4]benzochinon; 2-phenylsulfanyl-[1,4]benzoquinone; S-phenylthiobenzoquinone;Expand

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2-phenylsulfanylcyclohexa-2,5-diene-1,4-dione Basic Attributes

Molecular Weight：

216.25600

Exact Mass：

216.02450067 g/mol

NSC Number：

402911

DSSTox ID：

DTXSID20323046

HScode：

2930909090

Characteristics

PSA：

59.44000

XLogP3：

2.37060

Density：

1.31g/cm3

Boiling Point：

349.7ºC

Flash Point：

154.4ºC

Refractive Index：

1.653

Vapor Pressure：

4.62E-05mmHg at 25°C

Computed Properties

Molecular Weight:216.26
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:216.02450067
Monoisotopic Mass:216.02450067
Topological Polar Surface Area:59.4
Heavy Atom Count:15
Complexity:336
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-phenylsulfanylcyclohexa-2,5-diene-1,4-dione

Basic Attributes
Characteristics
Computed Properties

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