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Substance Name: Thymyl N-isoamylcarbamate
RN: 578-20-1
UNII: 9X61JQX8UL
InChIKey: IVFPIHZOFZLQJG-UHFFFAOYSA-N

Molecular Formula

  • C16-H25-N-O2

Molecular Weight

  • 263.3785
 
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Names and Synonyms

Name of Substance

  • Thymyl N-isoamylcarbamate

Synonyms

  • Carbamic acid, (3-methylbutyl)-, 5-methyl-2-(1-methylethyl)phenyl ester
  • Egressin
  • Isoamylcarbamic acid thymyl ester
  • Thymol N-isoamylcarbamate
  • Thymyl N-isoamylcarbamate
  • Thymyl N-isoamylcarbamate [MI]
  • UNII-9X61JQX8UL

Registry Numbers

CAS Registry Number

  • 578-20-1

FDA UNII

  • 9X61JQX8UL

System Generated Number

  • 0000578201

Structure Descriptors

InChI

1S/C16H25NO2/c1-11(2)8-9-17-16(18)19-15-10-13(5)6-7-14(15)12(3)4/h6-7,10-12H,8-9H2,1-5H3,(H,17,18)

InChIKey

IVFPIHZOFZLQJG-UHFFFAOYSA-N

Smiles

Cc1ccc(c(c1)OC(=O)NCCC(C)C)C(C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 57 deg C   EXP
log P (octanol-water) 4.810 (none)   EST
Atmospheric OH Rate Constant 2.42E-11 cm3/molecule-sec 25 EST

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