Cas no 127473-64-7 (2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI))

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) structure
127473-64-7 structure
Product Name:2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI)
CAS No:127473-64-7
MF:C8H12N2O
MW:152.193681716919
CID:103153
PubChem ID:14746490
Update Time:2025-04-18

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) Chemical and Physical Properties

Names and Identifiers

    • 2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI)
    • 2(1H)-Pyrimidinone, 5-(1-methylpropyl)-, (S)- (9CI)
    • 127473-64-7
    • 5-[(2S)-BUTAN-2-YL]-1H-PYRIMIDIN-2-ONE
    • (S)-5-(sec-Butyl)pyrimidin-2(1H)-one
    • Inchi： 1S/C8H12N2O/c1-3-6(2)7-4-9-8(11)10-5-7/h4-6H,3H2,1-2H3,(H,9,10,11)/t6-/m0/s1
    • InChI Key： RVGMWNNRDHCHHO-LURJTMIESA-N
    • SMILES： O=C1N=CC(=CN1)[C@@H](C)CC

Computed Properties

  • Exact Mass: 151.08723
  • Monoisotopic Mass: 152.094963011g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 218
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1
  • Topological Polar Surface Area: 41.5?2

Experimental Properties

  • PSA: 42.85

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) Production Method

Production Method 1

Reaction Conditions
1.1 Catalysts: Silica Solvents: Ethanol ;  4 h, 290 °C
Reference
Catalytic depolymerization of Kraft lignin to high yield alkylated-phenols over CoMo/SBA-15 catalyst in supercritical ethanol
Rana, Masud; et al, RSC Advances, 2023, 13(43), 30022-30039

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) Raw materials

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) Preparation Products

2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI) Related Literature

127473-64-7 (2(1H)-Pyrimidinone,5-(1-methylpropyl)-, (S)- (9CI)) Related Products

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