O-ethylhydroxylamine hydrochloride

• ChemBase ID: 146487
• Molecular Formular: C2H8ClNO
• Molecular Mass: 97.54402
• Monoisotopic Mass: 97.02944156
• SMILES: CCON.Cl
• Canonical SMILES: CCON.Cl
• InChI: InChI=1S/C2H7NO.ClH/c1-2-4-3;/h2-3H2,1H3;1H
• InChIKey: NUXCOKIYARRTDC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: O-ethylhydroxylamine hydrochloride
• IUPAC Traditional name: O-ethylhydroxylamine hydrochloride
• Synonyms: Ethoxyamine hydrochloride; O-Ethylhydroxylamine hydrochloride; Ethoxyamine hydrochloride; 乙氧胺 盐酸盐; O-乙基羟胺 盐酸盐

Database IDs

• CAS Number: 3332-29-4
• EC Number: 222-060-9
• MDL Number: MFCD00799598; MFCD00012956
• Beilstein Number: 3606639
• PubChem SID: 24845686; 24856619; 162240683
• PubChem CID: 76850

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.039242554
• LogD (pH = 7.4): -0.00616614
• Log P: -0.0057277023
• Molar Refractivity: 17.0796 cm^3
• Polarizability: 6.637073 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 128-132 °C; 130-133 °C(lit.)

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥97.0% (AT); 95+%; 97%
• Grade: purum
• Linear Formula: CH3CH2ONH2 · HCl

DETAILS

Sigma Aldrich - 274992

Packaging
1, 5 g in glass bottle