(1S,2S)-2-aminocyclobutan-1-ol

• ChemBase ID: 310137
• Molecular Formular: C4H9NO
• Molecular Mass: 87.12036
• Monoisotopic Mass: 87.06841391
• SMILES: [C@H]1([C@H](CC1)O)N
• Canonical SMILES: O[C@H]1CC[C@@H]1N
• InChI: InChI=1S/C4H9NO/c5-3-1-2-4(3)6/h3-4,6H,1-2,5H2/t3-,4-/m0/s1
• InChIKey: WXKBWWIWJCCING-IMJSIDKUSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1S,2S)-2-aminocyclobutan-1-ol
• IUPAC Traditional name: (1S,2S)-2-aminocyclobutan-1-ol
• Synonyms: rac-(1S,2S)-2-aminocyclobutanol

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -3.7912521
• LogD (pH = 7.4): -2.9746268
• Log P: -0.79022926
• Molar Refractivity: 23.0925 cm^3
• Polarizability: 9.517664 Å^3
• Polar Surface Area: 46.25 Å^2