2-methoxyethan-1-amine

• ChemBase ID: 90296
• Molecular Formular: C3H9NO
• Molecular Mass: 75.10966
• Monoisotopic Mass: 75.06841391
• SMILES: NCCOC
• Canonical SMILES: COCCN
• InChI: InChI=1S/C3H9NO/c1-5-3-2-4/h2-4H2,1H3
• InChIKey: ASUDFOJKTJLAIK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-methoxyethan-1-amine
• IUPAC Traditional name: ethanamine, 2-methoxy-
• Synonyms: 2-Methoxyethylamine; 1-Amino-2-methoxyethane; 2-Aminoethyl methyl ether; 2-Methoxyethylamine 98%; 2-氨基乙基甲醚; 2-甲氧基乙胺; 2-甲烷氧基乙基胺

Database IDs

• CAS Number: 109-85-3
• EC Number: 203-712-1
• MDL Number: MFCD00008180
• Beilstein Number: 741854
• PubChem SID: 24848603; 162077117; 24854461; 24883532
• PubChem CID: 8018

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.6555939
• LogD (pH = 7.4): -2.680308
• Log P: -0.6724344
• Molar Refractivity: 20.9623 cm^3
• Polarizability: 8.474427 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -82°C
• Boiling Point: 87-90°C; 95 °C(lit.); 95°C
• Flash Point: 12 °C; 12°C; 12°C(53°F); 53.6 °F
• Density: 0.864; 0.864 g/mL at 25 °C(lit.); 0.874
• Refractive Index: 1.4070; n20/D 1.406; n20/D 1.406(lit.)

Safety Information

• Storage Warning: Highly Flammable/Corrosive/Harmful
• RTECS: KR8750000
• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 2733; UN2733
• German water hazard class: 3
• Hazard Class: 3
• Packing Group: 2; II
• Risk Statements: 11-34
• Safety Statements: 16-26-36/37/39-45; 9-16-20-23-26-33-36/37/39-45-60
• TSCA Listed: 是
• GHS Pictograms: GHS02; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H314; H225-H314-H318
• GHS Precautionary statements: P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A; P210-P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2733 3/PG 2

Product Information

• Purity: ≥98.0% (GC); 98%; 99%
• Grade: purum
• Linear Formula: CH3OCH2CH2NH2

DETAILS

Sigma Aldrich - 241067

Packaging
50 mL in glass bottle