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Substance Name: Urea, N-(2,2-dimethoxyethyl)-N'-(5-(1,1-dimethylethyl)-1,3,4-thiadiazole-2-yl)-N-methyl-
RN: 51461-71-3
InChIKey: JEBBYIJCXLFPCX-UHFFFAOYSA-N

Molecular Formula

  • C12-H22-N4-O3-S

Molecular Weight

  • 302.397
 
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Names and Synonyms

Synonyms

  • N-(2,2-Dimethoxyethyl)-N'-(5-(1,1-dimethylethyl)-1,3,4-thiadiazole-2-yl)-N-methylurea
  • N-(2,2-Dimethoxyethyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)-N-methylurea

Systematic Names

  • Urea, N-(2,2-dimethoxyethyl)-N'-(5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl)-N-methyl-
  • Urea, N-(2,2-dimethoxyethyl)-N'-(5-(1,1-dimethylethyl)-1,3,4-thiadiazole-2-yl)-N-methyl-

Registry Numbers

CAS Registry Number

  • 51461-71-3

System Generated Number

  • 0051461713

Structure Descriptors

InChI

1S/C12H22N4O3S/c1-12(2,3)9-14-15-10(20-9)13-11(17)16(4)7-8(18-5)19-6/h8H,7H2,1-6H3,(H,13,15,17)

InChIKey

JEBBYIJCXLFPCX-UHFFFAOYSA-N

Smiles

c1(sc(C(C)(C)C)nn1)NC(N(CC(OC)OC)C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.830 (none)   EST
Water Solubility 4100 mg/L 25 EXP
Vapor Pressure 1.22E-08 mm Hg 25 EST
Henry's Law Constant 6.61E-16 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.79E-11 cm3/molecule-sec 25 EST

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