Cas no 5770-46-7 (6-BUTYLAMINO-1,3-DIMETHYLURACIL)

6-BUTYLAMINO-1,3-DIMETHYLURACIL structure
5770-46-7 structure
Product Name:6-BUTYLAMINO-1,3-DIMETHYLURACIL
CAS No:5770-46-7
MF:C10H17N3O2
MW:211.260882139206
CID:947436
PubChem ID:2262624
Update Time:2025-04-19

6-BUTYLAMINO-1,3-DIMETHYLURACIL Chemical and Physical Properties

Names and Identifiers

    • 6-BUTYLAMINO-1,3-DIMETHYLURACIL
    • 6-(butylamino)-1,3-dimethylpyrimidine-2,4-dione
    • 6-(butylamino)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
    • AB00095318-01
    • HMS3317H12
    • 5770-46-7
    • CCG-106508
    • BRD-K83512395-001-07-7
    • DB-369242
    • SMR000104180
    • BIM-0029506.P001
    • MLS000108219
    • HMS2167H07
    • 6-(butylamino)-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione
    • CHEMBL1405386
    • DTXSID80367380
    • AKOS000715199
    • EU-0004810
    • CBMicro_029651
    • STK169392
    • Inchi: 1S/C10H17N3O2/c1-4-5-6-11-8-7-9(14)13(3)10(15)12(8)2/h7,11H,4-6H2,1-3H3
    • InChI Key: FVVDHTAGKNRSPB-UHFFFAOYSA-N
    • SMILES: O=C1N(C)C(C=C(N1C)NCCCC)=O

Computed Properties

  • Exact Mass: 211.13221
  • Monoisotopic Mass: 211.132076794g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 299
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 0.8
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • PSA: 52.65

6-BUTYLAMINO-1,3-DIMETHYLURACIL Production Method

Production Method 1

Reaction Conditions
1.1 Catalysts: 4-(Dimethylamino)pyridine Solvents: Ethanol ;  24 h, reflux
Reference
Study on the synthesis of 6-alkylaminouridines via the nucleophilic aromatic substitution reaction of 6-cyanouridine derivatives
Lin, Jian-Bang; He, Jhih-Li; Shih, Yu-Chiao; Chien, Tun-Cheng, Tetrahedron Letters, 2011, 52(31), 3969-3972

6-BUTYLAMINO-1,3-DIMETHYLURACIL Raw materials

6-BUTYLAMINO-1,3-DIMETHYLURACIL Preparation Products

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