2,2,3,3-tetramethylazetidine

• ChemBase ID: 281370
• Molecular Formular: C7H15N
• Molecular Mass: 113.2007
• Monoisotopic Mass: 113.12044949
• SMILES: N1C(C(C1)(C)C)(C)C
• Canonical SMILES: CC1(C)NCC1(C)C
• InChI: InChI=1S/C7H15N/c1-6(2)5-8-7(6,3)4/h8H,5H2,1-4H3
• InChIKey: TXHIFFBQDXPZOA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,2,3,3-tetramethylazetidine
• IUPAC Traditional name: 2,2,3,3-tetramethylazetidine
• Synonyms: 2,2,3,3-tetramethylazetidine

Database IDs

• MDL Number: MFCD19222299
• PubChem SID: 180666901
• PubChem CID: 547141

CALCULATED PROPERTIES

• Log P: 1.3643831
• Molar Refractivity: 35.4061 cm^3
• Polarizability: 14.445701 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.8717587
• LogD (pH = 7.4): -1.5591506

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.893

Product Information

• Purity: 95%