N-{N-[2,6-bis(propan-2-yl)phenyl]carboximidoyl}-2,6-bis(propan-2-yl)aniline

• ChemBase ID: 287090
• Molecular Formular: C25H34N2
• Molecular Mass: 362.55086
• Monoisotopic Mass: 362.2721991
• SMILES: CC(c1c(c(C(C)C)ccc1)N=C=Nc1c(C(C)C)cccc1C(C)C)C
• Canonical SMILES: CC(c1cccc(c1N=C=Nc1c(cccc1C(C)C)C(C)C)C(C)C)C
• InChI: InChI=1S/C25H34N2/c1-16(2)20-11-9-12-21(17(3)4)24(20)26-15-27-25-22(18(5)6)13-10-14-23(25)19(7)8/h9-14,16-19H,1-8H3
• InChIKey: XLDBGFGREOMWSL-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-{N-[2,6-bis(propan-2-yl)phenyl]carboximidoyl}-2,6-bis(propan-2-yl)aniline
• IUPAC Traditional name: N-[N-(2,6-diisopropylphenyl)carboximidoyl]-2,6-diisopropylaniline
• Synonyms: N,N'-Methanediylidenebis(2,6-diisopropylaniline)

Database IDs

• CAS Number: 2162-74-5
• MDL Number: MFCD00082211
• PubChem SID: 180672621
• PubChem CID: 75100

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 9.024596
• LogD (pH = 7.4): 9.024596
• Log P: 9.024596
• Molar Refractivity: 120.6388 cm^3
• Polarizability: 44.73316 Å^3
• Polar Surface Area: 24.72 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%