2-bromoethan-1-amine hydrobromide

• ChemBase ID: 69402
• Molecular Formular: C2H7Br2N
• Molecular Mass: 204.89168
• Monoisotopic Mass: 202.89452323
• SMILES: NCCBr.Br
• Canonical SMILES: NCCBr.Br
• InChI: InChI=1S/C2H6BrN.BrH/c3-1-2-4;/h1-2,4H2;1H
• InChIKey: WJAXXWSZNSFVNG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-bromoethan-1-amine hydrobromide
• IUPAC Traditional name: 2-bromoethanamine hydrobromide
• Synonyms: 2-Aminoethyl bromide hydrobromide; 2-Bromoethylamine hydrobromide; 2-Bromoethylamine hydrobromide; 1-Amino-2-bromoethane hydrobromide; AMINOETHYL BROMIDE HYDROBROMIDE; 2-BROMOETHYLAMINE; 2-BROMOETHYLAMINE HYDROBROMIDE; AMINOETHYL BROMIDE HYDROBROMIDE; 2-bromoethan-1-amine hydrobromide; 2-氨基乙基溴 氢溴酸盐; 2-溴乙胺 氢溴酸盐; 2-溴乙胺 氢溴化物

Database IDs

• CAS Number: 2576-47-8
• EC Number: 219-924-2
• MDL Number: MFCD00012886
• Beilstein Number: 3607605
• PubChem SID: 24891920; 24845955; 162035128
• PubChem CID: 2774217

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.5470865
• LogD (pH = 7.4): -1.0099831
• Log P: 0.22452624
• Molar Refractivity: 22.2456 cm^3
• Polarizability: 8.794316 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 170-175 °C; 170-175 °C(lit.); 172-174°C; 172-176°C
• Hydrophobicity(logP): 0.068

Safety Information

• Storage Condition: Room Temperature (15-30°C), Desiccate
• Storage Warning: Hygroscopic; IRRITANT; Irritant
• RTECS: KQ8225000
• European Hazard Symbols: X; Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 22-36/37/38-43; 36/37/38
• Safety Statements: 24-26-37; 26-36/37
• TSCA Listed: false; 是
• GHS Pictograms: GHS06; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H301-H315-H319-H317-H335; H315-H319-H335
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A; P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: ≥97.0% (AT); 95%; 95+%; 98+%; 99%
• Grade: purum
• Salt Data: HBr
• Linear Formula: BrCH2CH2NH2 · HBr

DETAILS

MP Biomedicals - 05215439

MP Biomedicals Rare Chemical collection

MP Biomedicals - 02154875

Hydrobromide Crystalline

Sigma Aldrich - B65705

Application
Used to construct C2-symmetric imidazolidinylidene ligands with a dioxolane backbone.1
Packaging
25, 100 g in glass bottle