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AKOSB000896

AKOSB000896 structure

AKOSB000896 

structure
  • CAS No:

    350990-25-9

  • Formula:

    C18H23NO2S

  • Chemical Name:

    AKOSB000896

  • Synonyms:

    AKOS B000896;BIM-0046714.P001;CBMicro_046847;ethyl 2-amino-5-methyl-4-[4-(2-methylpropyl)phenyl]thiophene-3-carboxylate;IVK/9049635;Oprea1_692259;ZINC02387665;ART-CHEM-BB B000896

AKOSB000896 Basic Attributes

317.45

317.14495015

Characteristics

1.120±0.06 g/cm3

429.8±45.0 °C(Predicted)

0.24±0.14

Safety Information

IRRITANT

Xi

Computed Properties

Molecular Weight:317.4
XLogP3:5.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:317.14495015
Monoisotopic Mass:317.14495015
Topological Polar Surface Area:80.6
Heavy Atom Count:22
Complexity:366
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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