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Home > Encyclopedia > METHYL(R)-3-PHENYLBUTYRATE

METHYL(R)-3-PHENYLBUTYRATE

METHYL(R)-3-PHENYLBUTYRATE structure

METHYL(R)-3-PHENYLBUTYRATE 

structure
  • CAS No:

    1472-07-7

  • Formula:

    C11H14O2

  • Chemical Name:

    METHYL(R)-3-PHENYLBUTYRATE

  • Synonyms:

    METHYL(R)-3-PHENYLBUTYRATE;(R)-methyl3-phenylbutanoate;methyl(r)-β-methylhydrocinnamate;METHYL(R)-BETA-METHYLHYDROCINNAMATE

METHYL(R)-3-PHENYLBUTYRATE Basic Attributes

178.22800

178.09900

2916399090

Characteristics

26.30000

2.35320

1.020 g/mL at 20ºC(lit.)

234.2ºC at 760 mmHg

95ºC

n20/D 1.497

0.0537mmHg at 25°C

Safety Information

S23

Computed Properties

Molecular Weight:178.23
XLogP3:2.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:160
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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