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Phenylethyl hexanoate

Phenylethyl hexanoate structure

Phenylethyl hexanoate 

structure
  • CAS No:

    6290-37-5

  • Formula:

    C14H20O2

  • Chemical Name:

    Phenylethyl hexanoate

  • Synonyms:

    Hexanoic acid,2-phenylethyl ester;Hexanoic acid,phenethyl ester;2-Phenethyl hexanoate;2-Phenylethyl caproate;2-Phenylethyl hexanoate;Phenylethyl hexanoate;Phenethyl hexanoate;NSC 6651

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

Colourless oily liquid; fruity-green, rosy, fresh pineapple-like, banana-like odour

Phenylethyl hexanoate Basic Attributes

220.31

220.31

228-538-3

X7R57M68KR

6651

DTXSID5047584

Characteristics

26.3 Ų

0.971 g/mL at 25 °C(lit.)

144-146 °C @ Press: 2 Torr

n20/D 1.486(lit.)

Insoluble in water; soluble in oils|Miscible at room temperature (in ethanol)

Safety Information

3

Phenylethyl hexanoate Use and Manufacturing

Hexanoic acid, 2-phenylethyl ester: ACTIVE

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Flavoring Agents

Computed Properties

Molecular Weight:220.31
XLogP3:4.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:220.146329876
Monoisotopic Mass:220.146329876
Topological Polar Surface Area:26.3
Heavy Atom Count:16
Complexity:183
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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