2-(dimethylamino)-2-methylpropan-1-ol

• ChemBase ID: 108702
• Molecular Formular: C6H15NO
• Molecular Mass: 117.1894
• Monoisotopic Mass: 117.11536411
• SMILES: CN(C)C(C)(C)CO
• Canonical SMILES: OCC(N(C)C)(C)C
• InChI: InChI=1S/C6H15NO/c1-6(2,5-8)7(3)4/h8H,5H2,1-4H3
• InChIKey: XRIBIDPMFSLGFS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(dimethylamino)-2-methylpropan-1-ol
• IUPAC Traditional name: dmamp
• Synonyms: 2-(N,N-DIMETHYLAMINO)ISOBUTANOL; 2-Dimethylamino-2-methyl-1-propanol; DMAMP-80™; 2-Dimethylamino-2-methylpropanol solution; 2-(dimethylamino)-2-methylpropan-1-ol; 2-二甲胺基-2-甲基-1-丙醇; 2-二甲胺基-2-甲基丙醇 溶液

Database IDs

• CAS Number: 7005-47-2
• EC Number: 230-279-6
• MDL Number: MFCD00021978
• Beilstein Number: 1732837
• PubChem SID: 24864424; 24866471; 162095645
• PubChem CID: 23435

CALCULATED PROPERTIES

• Acid pKa: 14.788836
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.2046504
• LogD (pH = 7.4): -1.9752216
• Log P: 0.19721915
• Molar Refractivity: 35.3374 cm^3
• Polarizability: 13.926987 Å^3
• Polar Surface Area: 23.47 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 19°C
• Boiling Point: 158-160 °C(lit.); 160°C; 61 °C/20 mmHg
• Flash Point: 145 °F; 63 °C
• Density: 0.90 g/ml; 0.91 g/mL at 25 °C; 0.95 g/mL at 20 °C(lit.)
• Refractive Index: n20/D 1.44; n20/D 1.447
• Hydrophobicity(logP): 0.311

Safety Information

• RTECS: UB3325000
• European Hazard Symbols: Corrosive (C)
• UN Number: 2735
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 3
• Risk Statements: 34; R:34
• Safety Statements: 23-26-36/37/39-45; 26-36/37/39-45; S:26-27/28-36/37/39-46-64
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• RID/ADR: UN 2735 8/PG 3

Product Information

• Purity: ~80% (NT); 95%
• Concentration: 80% in H2O
• Grade: technical; technical grade
• Impurities: ~20% water
• Linear Formula: (CH3)2C(CH2OH)N(CH3)2

DETAILS

Sigma Aldrich - 423041

Packaging
100 mL in glass bottle
Legal Information
DMAMP-80 is a trademark of Angus Chemie GmbH