3-dodecylsulfanyl-4-hydroxynaphthalene-1,2-dione
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3-dodecylsulfanyl-4-hydroxynaphthalene-1,2-dione
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CAS No:
39226-85-2
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Formula:
C22H30O3S
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Chemical Name:
3-dodecylsulfanyl-4-hydroxynaphthalene-1,2-dione
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Synonyms:
2-hydroxy-3-n-dodecylmercapto-1,4-naphthoquinone;39226-85-2;UNII-U1HK509YDL;U1HK509YDL;2-Hydroxy-3-n-dodecylmercapto-1,4-naphthoquinone;NSC180804;NSC 180804;1,4-Naphthalenedione, 2-(dodecylthio)-3-hydroxy-;SCHEMBL3275846;DTXSID50959998;1, 2-(dodecylthio)-3-hydroxy-;NSC-180804;2-(Dodecylsulfanyl)-3-hydroxynaphthoquinone #;3-n-Dodecylmercapto-2-hydroxy-1,4-naphthoquinoe;2-(Dodecylsulfanyl)-3-hydroxynaphthalene-1,4-dione;C1=CC=C2C(=O)C(SCCCCCCCCCCCC)=C(O)C(=O)C2=C1
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CAS No:
3-dodecylsulfanyl-4-hydroxynaphthalene-1,2-dione Basic Attributes
374.5 g/mol
374.19156599 g/mol
U1HK509YDL
180804
Computed Properties
Molecular Weight:374.5
XLogP3:7.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:12
Exact Mass:374.19156599
Monoisotopic Mass:374.19156599
Topological Polar Surface Area:79.7
Heavy Atom Count:26
Complexity:498
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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