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1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione

1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione structure

CAS No:
24108-92-7
Formula:
C24H21NO6S
Chemical Name:
1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione
Synonyms:
9,10-Anthracenedione,1-amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-;Anthraquinone,1-amino-2-[p-(butylsulfonyl)phenoxy]-4-hydroxy-;1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione;NSC 127625

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1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione Basic Attributes

Molecular Weight：

451.49200

Exact Mass：

451.49

NSC Number：

127625

DSSTox ID：

DTXSID00178834

HScode：

2922509090

Characteristics

PSA：

132.14000

XLogP3：

5.77790

Density：

1.403g/cm3

Boiling Point：

701.7ºC at 760mmHg

Flash Point：

378.2ºC

Refractive Index：

1.653

Vapor Pressure：

2.41E-20mmHg at 25°C

Computed Properties

Molecular Weight:451.5
XLogP3:5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:451.10895856
Monoisotopic Mass:451.10895856
Topological Polar Surface Area:132
Heavy Atom Count:32
Complexity:800
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-Amino-2-[4-(butylsulfonyl)phenoxy]-4-hydroxy-9,10-anthracenedione

Basic Attributes
Characteristics
Computed Properties

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