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pentan-3-yl hexanoate

pentan-3-yl hexanoate structure

pentan-3-yl hexanoate 

structure
  • CAS No:

    5416-46-6

  • Formula:

    C11H22O2

  • Chemical Name:

    pentan-3-yl hexanoate

  • Synonyms:

    pentan-3-yl hexanoate;5416-46-6;NSC6822;Hexanoic acid, 3-pentyl ester;SCHEMBL2721360;DTXSID80278260;Hexanoic acid 1-ethylpropyl ester;NSC-6822;ZINC1867005

  • Categories:

    Organic Chemistry  >  Ethers and Derivatives

pentan-3-yl hexanoate Basic Attributes

186.29 g/mol

186.161979940 g/mol

6822

DTXSID80278260

Characteristics

26.3 Ų

Computed Properties

Molecular Weight:186.29
XLogP3:3.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:186.161979940
Monoisotopic Mass:186.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:128
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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