Cas no 117229-60-4 (4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl-)

4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl- structure
117229-60-4 structure
Product Name:4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl-
CAS No:117229-60-4
MF:C6H10N2O3
MW:158.155201435089
CID:194153
PubChem ID:3081125
Update Time:2025-04-19

4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl-
    • 2-methyl-4-carboxy-5-hydroxy-3,4,5,6-tetrahydropyrimidine
    • 5-hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
    • 5-hydroxy-2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
    • 1,4,5,6-Tetrahydro-5-hydroxy-2-methyl-4-pyrimidinecarboxylic acid
    • 4-Pyrimidinecarboxylicacid,3,4,5,6-tetrahydro-5-hydroxy-2-methyl
    • A902295
    • (S,S)-beta-Hydroxyectoine; 5-Hydroxyectoine; Pyrostatin A; Pyrostatine A; beta-Hydroxyectoine
    • 5-Hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
    • 4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-5-hydroxy-2-methyl-
    • 2-methyl-4-carboxy-5-hydroxy-3,4,5,6,-tetrahydropyrimidine
    • 5-Hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylicacid
    • FT-0709695
    • 1,4,5,6-tetrahydro-2-methyl-5-hydroxy-4-pyrimidinecarboxylic acid
    • NS00009311
    • Thp(A)
    • 117229-60-4
    • SCHEMBL975252
    • DTXSID70922341
    • Inchi: 1S/C6H10N2O3/c1-3-7-2-4(9)5(8-3)6(10)11/h4-5,9H,2H2,1H3,(H,7,8)(H,10,11)
    • InChI Key: KIIBBJKLKFTNQO-UHFFFAOYSA-N
    • SMILES: OC1CN=C(C)NC1C(=O)O

Computed Properties

  • Exact Mass: 158.06900
  • Monoisotopic Mass: 158.069
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 202
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.2
  • Topological Polar Surface Area: 81.9?2

Experimental Properties

  • Density: 1.56
  • Boiling Point: 465.2°Cat760mmHg
  • Flash Point: 235.2°C
  • Refractive Index: 1.634
  • PSA: 81.92000
  • LogP: -1.41350

4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-5-hydroxy-2-methyl- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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5-Hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
117229-60-4 95%
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$1035 2023-01-12

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