ethyl 2-hydrazinylacetate hydrochloride

• ChemBase ID: 17409
• Molecular Formular: C4H11ClN2O2
• Molecular Mass: 154.59534
• Monoisotopic Mass: 154.05090528
• SMILES: C(=O)(CNN)OCC.Cl
• Canonical SMILES: CCOC(=O)CNN.Cl
• InChI: InChI=1S/C4H10N2O2.ClH/c1-2-8-4(7)3-6-5;/h6H,2-3,5H2,1H3;1H
• InChIKey: HZZRIIPYFPIKHR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ethyl 2-hydrazinylacetate hydrochloride
• IUPAC Traditional name: ethyl 2-hydrazinylacetate hydrochloride
• Synonyms: Hydrazino-acetic acid ethyl ester hydrochloride; ethyl 2-hydrazinylacetate hydrochloride; ETHYL HYDRAZINEACETATE HYDROCHLORIDE; Ethyl hydrazinoacetate hydrochloride; 肼基乙酸乙酯 盐酸盐

Database IDs

• CAS Number: 6945-92-2
• EC Number: 230-104-3
• MDL Number: MFCD00012923
• Beilstein Number: 3912112
• PubChem SID: 24878364; 160980716; 24847839
• PubChem CID: 11593468

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -0.909308
• LogD (pH = 7.4): -0.8305318
• Log P: -0.829429
• Molar Refractivity: 40.498 cm^3
• Polarizability: 11.758041 Å^3
• Polar Surface Area: 64.35 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 152 - 154°C; 152-154 °C(lit.)
• Hydrophobicity(logP): -0.491

Safety Information

• Storage Warning: IRRITANT
• German water hazard class: 3
• TSCA Listed: false
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Purity: ≥97.0% (AT); 95%; 97%
• Grade: purum
• Linear Formula: H2NNHCH2CO2C2H5 · HCl

DETAILS

MP Biomedicals - 05208182

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 128279

Packaging
25 g in poly bottle
5 g in glass bottle