2-(ethylsulfanyl)-6...

2-(ethylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carbaldehyde - ethanol (1:1) 5337-13-3

2-(ethylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carbaldehyde - ethanol (1:1) 5337-13-3

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1 Kilogram

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  • Min.Order :1 Kilogram
  • Purity: 99%
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Keywords

ethanol; 2-ethylsulfanyl-6-oxo-3H-pyrimidine-4-carbaldehyde 5337-13-3 98%

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  • Appearance:Solid
  • Application:Organic Chemicals
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  • ProductionCapacity:100|Kilogram|Month
  • Storage:room temperature
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Details:

Identification and Related Records
【Name】
2-(ethylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carbaldehyde - ethanol (1:1)
【CAS Registry number】
5337-13-3
【Synonyms】
2-(ethylsulfanyl)-6-oxo-3,6-dihydropyrimidine-4-carbaldehyde- ethanol(1:1)
NSC413
AC1Q6POK
AC1L56HL
NSC-413
AR-1C9265
ethanol
2-ethylsulfanyl-4-oxo-1H-pyrimidine-6-carbaldehyde
2-(ETHYLTHIO)-6-HYDROXY-4-PYRIMIDINECARBOXALDEHYDE COMPD WITH ETHANOL (1:1)
【Molecular Formula】
C9H14N2O3S (Products with the same molecular formula)
【Molecular Weight】
230.2841
【Inchi】
InChI=1/C7H8N2O2S.C2H6O/c1-2-12-7-8-5(4-10)3-6(11)9-7;1-2-3/h3-4H,2H2,1H3,(H,8,9,11);3H,2H2,1H3
【Canonical SMILES】
CCO.CCSC1=NC(=O)C=C(N1)C=O
【MOL File】
5337-13-3.mol
Chemical and Physical Properties
【Boiling Point】
327.4°C at 760 mmHg
【Flash Point】
151.8°C
【Computed Properties】
Molecular Weight:230.28406 [g/mol]
Molecular Formula:C9H14N2O3S
H-Bond Donor:2
H-Bond Acceptor:4
Rotatable Bond Count:3
Tautomer Count:3
Exact Mass:230.072513
MonoIsotopic Mass:230.072513
Topological Polar Surface Area:104
Heavy Atom Count:15
Formal Charge:0
Complexity:273
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2

 

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