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Substance Name: Carvacryl acetate
RN: 6380-28-5
UNII: 2A2BR75B36
InChIKey: OXZSUQJHKQOGOK-UHFFFAOYSA-N

Note

  • A derivative of carvacrol that reduces nociceptive and inflammatory response in mice.

Molecular Formula

  • C12-H16-O2

Molecular Weight

  • 192.256
 
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Names and Synonyms

Name of Substance

  • Carvacryl acetate

Synonyms

  • AI3-03429
  • Carvacryl acetate
  • EINECS 228-963-4
  • UNII-2A2BR75B36

Systematic Names

  • 5-Isopropyl-o-tolyl acetate
  • Phenol, 2-methyl-5-(1-methylethyl)-, acetate

Registry Numbers

CAS Registry Number

  • 6380-28-5

FDA UNII

  • 2A2BR75B36

System Generated Number

  • 0006380285

Structure Descriptors

InChI

1S/C12H16O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5-8H,1-4H3

InChIKey

OXZSUQJHKQOGOK-UHFFFAOYSA-N

Smiles

c1(cc(C(C)C)ccc1C)OC(=O)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 246.5 deg C   EXP
log P (octanol-water) 3.590 (none)   EST
Atmospheric OH Rate Constant 8.30E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.