dimethyl(1-phenylethyl)amine

• ChemBase ID: 109024
• Molecular Formular: C10H15N
• Molecular Mass: 149.2328
• Monoisotopic Mass: 149.12044949
• SMILES: CC(N(C)C)c1ccccc1
• Canonical SMILES: CC(c1ccccc1)N(C)C
• InChI: InChI=1S/C10H15N/c1-9(11(2)3)10-7-5-4-6-8-10/h4-9H,1-3H3
• InChIKey: BVURNMLGDQYNAF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dimethyl(1-phenylethyl)amine
• IUPAC Traditional name: benzylamine, N,N,α-trimethyl-
• Synonyms: N,N'-DIMETHYL-α-METHYLBENZYLAMINE; N,N,alpha-Trimethylbenzylamine; N,N-Dimethyl-1-phenylethylamine; N,N-二甲基-1-苯乙胺

Database IDs

• CAS Number: 2449-49-2
• EC Number: 219-511-7
• MDL Number: MFCD00064770
• PubChem SID: 162094944
• PubChem CID: 86536

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.98300785
• LogD (pH = 7.4): 0.46562663
• Log P: 2.3312175
• Molar Refractivity: 49.0195 cm^3
• Polarizability: 19.290483 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 193°C

Safety Information

• RTECS: DP6825000
• European Hazard Symbols: X
• Risk Statements: 21/22-36/37/38
• Safety Statements: 26-36/37
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H311-H315-H319-H335-H227
• GHS Precautionary statements: P210-P301+P310-P305+P351+P338-P361-P405-P501A

Product Information

• Purity: 97%

DETAILS

MP Biomedicals - 05209570

MP Biomedicals Rare Chemical collection