Cas no 96084-09-2 (L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3) (9CI))

L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3) (9CI) structure
96084-09-2 structure
Product Name:L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3) (9CI)
CAS No:96084-09-2
MF:C6H13NO2
MW:149.24590587616
CID:803657
PubChem ID:71777658
Update Time:2025-04-19

L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3) (9CI) Chemical and Physical Properties

Names and Identifiers

    • L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3) (9CI)
    • LEUCINE, L-[3,4,5-3H(N)]-
    • 96084-09-2
    • L-Norvaline-3,3,4,5,5,5-t6,4-(methyl-t3)(9ci)
    • Leucine,l,[3,4,5-3H]
    • Inchi: 1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1/i1T3,2T3,3T2,4T
    • InChI Key: ROHFNLRQFUQHCH-RXAPIVOSSA-N
    • SMILES: OC([C@H](C([3H])([3H])C([3H])(C([3H])([3H])[3H])C([3H])([3H])[3H])N)=O

Computed Properties

  • Exact Mass: 149.168646902g/mol
  • Monoisotopic Mass: 149.168646902g/mol
  • Isotope Atom Count: 9
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 3
  • Complexity: 101
  • 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: -1.5
  • Topological Polar Surface Area: 63.3?2
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