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Home> Hot Product Listed 2   > 2,4(3H,5H)-Pyrimidinedione,5,5-dipropyl-6-(3-pyridinylamino)-
305858-63-3 structure

2,4(3H,5H)-Pyrimidinedione,5,5-dipropyl-6-(3-pyridinylamino)-

Iupac Name:6-[(4-propan-2-yloxybenzoyl)amino]hexanoic acid
CAS No.:305858-63-3
Molecular Weight:293.363
Molecular Formula:C16H18CLNO2 (isomer)
Names and Identifiers
Synonyms

2,4(3h,5h)-pyrimidinedione, 5,5-dipropyl-6-(3-pyridinylamino)- 5,5-dipropyl-4-(3-pyridinyl)iminobarbituric acid 5,5-dipropyl-6-(pyridin-3-ylamino)-2,4(3h,5h)-pyrimidinedione 5,5-dipropyl-6-(pyridin-3-ylamino)-3h-pyrimidine-2,4-dione 5,5-dipropyl-6-(pyridin-3-ylamino)pyrimidine-2,4-dione AC1MI8OR ACMC-20M96M AKOS016034187 brn 5592647 CTK4A4192 DTXSID90147397 HE159939 LS-135360

Inchi
InChI=1S/C16H23NO4/c1-12(2)21-14-9-7-13(8-10-14)16(20)17-11-5-3-4-6-15(18)19/h7-10,12H,3-6,11H2,1-2H3,(H,17,20)(H,18,19)
InChkey
ADKUSKGEMZYATO-UHFFFAOYSA-N
Canonical Smiles
CC(C)OC1=CC=C(C=C1)C(=O)NCCCCCC(=O)O
Properties
Boiling Point
545.6°C at 760 mmHg
Flash Point
137°C
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:293.363g/mol
  • Molecular Formula:C16H18CLNO2
  • Compound Is Canonicalized:True
  • Exact Mass:293.163
  • Monoisotopic Mass:293.163
  • Complexity:322
  • Rotatable Bond Count:9
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:4
  • Heavy Atom Count:21
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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