4-Imidazoleacetic acid hydrochloride

• CAS: 3251-69-2
• Catalog Number: ACM3251692
• Category: Main Products
• Molecular Weight: 162.57
• Molecular Formula: C5H7ClN2O2
• Synonyms: 1H-Imidazole-5-acetic acid hydrochloride
• IUPAC Name: 1H-Imidazole
• Canonical SMILES: C1=CN=CN1
• InChI: InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)
• InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N
• Boiling Point: 257 °C
• Melting Point: 218-222 °C(lit.)
• Flash Point: 145 °C
• Density: 1.426 g/cm³
• Solubility: Soluble in water
• Appearance: Solid
• Storage: Inert atmosphere, room temperature
• Complexity: 28.1
• Exact Mass: 68.037448136
• Monoisotopic Mass: 68.037448136
• Topological Polar Surface Area: 28.7 Ų

Custom Q&A

What is the molecular formula of 4-Imidazoleacetic acid hydrochloride?

The molecular formula of 4-Imidazoleacetic acid hydrochloride is C5H7ClN2O2.

What are the synonyms for 4-Imidazoleacetic acid hydrochloride?

The synonyms for 4-Imidazoleacetic acid hydrochloride are 3251-69-2, 2-(1H-imidazol-5-yl)acetic acid hydrochloride, 2-(1H-Imidazol-4-Yl)Acetic Acid Hydrochloride, and Imidazole-4-acetic acid hydrochloride.

What is the molecular weight of 4-Imidazoleacetic acid hydrochloride?

The molecular weight of 4-Imidazoleacetic acid hydrochloride is 162.57 g/mol.

What is the IUPAC name of 4-Imidazoleacetic acid hydrochloride?

The IUPAC name of 4-Imidazoleacetic acid hydrochloride is 2-(1H-imidazol-5-yl)acetic acid;hydrochloride.

What is the InChI of 4-Imidazoleacetic acid hydrochloride?

The InChI of 4-Imidazoleacetic acid hydrochloride is InChI=1S/C5H6N2O2.ClH/c8-5(9)1-4-2-6-3-7-4;/h2-3H,1H2,(H,6,7)(H,8,9);1H.

What is the InChIKey of 4-Imidazoleacetic acid hydrochloride?

The InChIKey of 4-Imidazoleacetic acid hydrochloride is MWHLCFYPFGFBQO-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Imidazoleacetic acid hydrochloride?

The Canonical SMILES of 4-Imidazoleacetic acid hydrochloride is C1=C(NC=N1)CC(=O)O.Cl.

What is the CAS number of 4-Imidazoleacetic acid hydrochloride?

The CAS number of 4-Imidazoleacetic acid hydrochloride is 3251-69-2.

What is the Hydrogen Bond Donor Count of 4-Imidazoleacetic acid hydrochloride?

The Hydrogen Bond Donor Count of 4-Imidazoleacetic acid hydrochloride is 3.

What is the Rotatable Bond Count of 4-Imidazoleacetic acid hydrochloride?

The Rotatable Bond Count of 4-Imidazoleacetic acid hydrochloride is 2.