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Home > Encyclopedia > ETHYL 5-METHYLHEXANOATE

ETHYL 5-METHYLHEXANOATE

ETHYL 5-METHYLHEXANOATE structure

ETHYL 5-METHYLHEXANOATE 

structure
  • CAS No:

    10236-10-9

  • Formula:

    C9H18O2

  • Chemical Name:

    ETHYL 5-METHYLHEXANOATE

  • Synonyms:

    Ethyl 5-methylhexanoate;NSC33948;ethanol-isoamylacetate;SCHEMBL127142;CTK4A0945;DTXSID20283873;5-Methylhexanoic acid ethyl ester;5-methyl-hexanoic acid ethyl ester;ZINC1665977;MFCD02258638

Description

Ethyl 5-methylhexanoate is a fatty acid ester.

ETHYL 5-METHYLHEXANOATE Basic Attributes

158.24

158.131

33948

DTXSID20283873

Characteristics

26.3

2.6

0.874±0.06 g/cm3(Predicted)

182.7 °C(Press: 750 Torr)

Safety Information

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:158.24
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:158.130679813
Monoisotopic Mass:158.130679813
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:108
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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