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2-(Butylamino)-1,4-naphthalenedione

2-(Butylamino)-1,4-naphthalenedione structure

CAS No:
59094-50-7
Formula:
C14H15NO2
Chemical Name:
2-(Butylamino)-1,4-naphthalenedione
Synonyms:
1,4-Naphthalenedione,2-(butylamino)-;1,4-Naphthoquinone,2-(butylamino)-;2-(Butylamino)-1,4-naphthalenedione;2-(Butylamino)-1,4-naphthoquinone;NSC 225988

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2-(Butylamino)-1,4-naphthalenedione Basic Attributes

Molecular Weight：

229.27 g/mol

Exact Mass：

229.27

NSC Number：

225988

DSSTox ID：

DTXSID30310346

Characteristics

PSA：

46.2 Å²

XLogP3：

3.11 (LogP)

Melting Point：

124-125 °C

Computed Properties

Molecular Weight:229.27
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:229.110278721
Monoisotopic Mass:229.110278721
Topological Polar Surface Area:46.2
Heavy Atom Count:17
Complexity:346
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(Butylamino)-1,4-naphthalenedione

Basic Attributes
Characteristics
Computed Properties

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