(2R)-1-methoxypropan-2-amine

• ChemBase ID: 70928
• Molecular Formular: C4H11NO
• Molecular Mass: 89.13624
• Monoisotopic Mass: 89.08406398
• SMILES: N[C@@H](COC)C
• Canonical SMILES: COC[C@H](N)C
• InChI: InChI=1S/C4H11NO/c1-4(5)3-6-2/h4H,3,5H2,1-2H3/t4-/m1/s1
• InChIKey: NXMXETCTWNXSFG-SCSAIBSYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2R)-1-methoxypropan-2-amine
• IUPAC Traditional name: (2R)-1-methoxypropan-2-amine
• Synonyms: (R)-(-)-1-Methoxy-2-propylamine; (2R)-1-methoxypropan-2-amine

Database IDs

• CAS Number: 99636-38-1
• MDL Number: MFCD03093084
• PubChem SID: 162036636
• PubChem CID: 10313069

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.2594244
• LogD (pH = 7.4): -2.4717588
• Log P: -0.25585935
• Molar Refractivity: 25.3811 cm^3
• Polarizability: 10.314882 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.223

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%; 95+%