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Cetyl gallate

Cetyl gallate structure

Cetyl gallate 

structure
  • CAS No:

    5026-65-3

  • Formula:

    C23H38O5

  • Chemical Name:

    Cetyl gallate

  • Synonyms:

    Benzoic acid,3,4,5-trihydroxy-,hexadecyl ester;Gallic acid,hexadecyl ester;1-Hexadecanol,gallate;Nipagallin CE;Progallin CE;Cetyl gallate;Palmityl gallate;Gallic acid,cetyl ester;Hexadecyl gallate

Cetyl gallate Basic Attributes

394.54500

394.54

225-715-7

X1J85N35ZO

DTXSID00198254

2918290000

Characteristics

86.99000

6.44150

1.065 g/cm3

99.5-100 °C

562.6ºC at 760 mmHg

185.1ºC

1.523

Safety Information

3

R11:Highly Flammable. R34:Causes burns.

S22-S24/25

Xi,C,F

Computed Properties

Molecular Weight:394.5
XLogP3:8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:17
Exact Mass:394.27192431
Monoisotopic Mass:394.27192431
Topological Polar Surface Area:87
Heavy Atom Count:28
Complexity:375
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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