Cas no 144731-95-3 (Isovaline,3,3-dimethyl- (9CI))

Isovaline,3,3-dimethyl- (9CI) structure
Isovaline,3,3-dimethyl- (9CI) structure
Product Name:Isovaline,3,3-dimethyl- (9CI)
CAS No:144731-95-3
MF:C7H15NO2
MW:145.199502229691
CID:108860
PubChem ID:13314536
Update Time:2025-04-18

Isovaline,3,3-dimethyl- (9CI) Chemical and Physical Properties

Names and Identifiers

    • Isovaline,3,3-dimethyl- (9CI)
    • 2-amino-2,3,3-trimethylbutanoic acid
    • SCHEMBL3821556
    • 144731-95-3
    • (R)-2-Amino-2,3,3-trimethylbutyric acid hydrochloride
    • EN300-7006501
    • AKOS006360264
    • trimethylaminobutyric acid
    • Inchi: 1S/C7H15NO2/c1-6(2,3)7(4,8)5(9)10/h8H2,1-4H3,(H,9,10)
    • InChI Key: QIGAECVGPWRCHY-UHFFFAOYSA-N
    • SMILES: OC(C(C)(C(C)(C)C)N)=O

Computed Properties

  • Exact Mass: 145.11035
  • Monoisotopic Mass: 145.110278721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 148
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.5
  • Topological Polar Surface Area: 63.3?2

Experimental Properties

  • PSA: 63.32

Isovaline,3,3-dimethyl- (9CI) Pricemore >>

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