(dicyclopropylmethyl)(methyl)amine

• ChemBase ID: 266275
• Molecular Formular: C8H15N
• Molecular Mass: 125.2114
• Monoisotopic Mass: 125.12044949
• SMILES: C1(CC1)C(C1CC1)NC
• Canonical SMILES: CNC(C1CC1)C1CC1
• InChI: InChI=1S/C8H15N/c1-9-8(6-2-3-6)7-4-5-7/h6-9H,2-5H2,1H3
• InChIKey: UUBORRNHRKSVNH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (dicyclopropylmethyl)(methyl)amine
• IUPAC Traditional name: (dicyclopropylmethyl)(methyl)amine
• Synonyms: (dicyclopropylmethyl)(methyl)amine; (dicyclopropylmethyl)methylamine

Database IDs

• CAS Number: 884504-77-2
• MDL Number: MFCD05864513
• PubChem SID: 164322185
• PubChem CID: 16788204

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.810358
• LogD (pH = 7.4): -1.5926491
• Log P: 1.4280431
• Molar Refractivity: 38.2476 cm^3
• Polarizability: 15.551486 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.208

Product Information

• Purity: 95%