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Home > Encyclopedia > Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester structure

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester 

structure
  • CAS No:

    5457-44-3

  • Formula:

    C8H12O5

  • Chemical Name:

    Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester

  • Synonyms:

    Hexanedioic acid,3-oxo-,1,6-dimethyl ester;Hexanedioic acid,3-oxo-,dimethyl ester;Dimethyl 3-oxohexanedioate;Dimethyl 3-oxoadipate;Dimethyl β-ketoadipate;NSC 24878;3-Oxoadipic acid dimethyl ester;1,6-Dimethyl 3-oxohexanedioate;3-Ketohexanedioic acid dimethyl ester

  • Categories:

    Chemical Reagents  >  Organic Reagents

Hexanedioic acid, 3-oxo-, 1,6-dimethyl ester Basic Attributes

188.17800

188.18

226-716-5

24878

DTXSID70202993

2918300090

Characteristics

69.67000

0.07180

1.142g/cm3

122 °C @ Press: 0.5 Torr

107.7ºC

n20/D 1.444

Safety Information

S23-S24/25

Computed Properties

Molecular Weight:188.18
XLogP3:-0.3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:188.06847348
Monoisotopic Mass:188.06847348
Topological Polar Surface Area:69.7
Heavy Atom Count:13
Complexity:209
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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