3-Amino-2-piperazin-1-ylbenzoic acid

Base Information

• Chemical Name: 3-Amino-2-piperazin-1-ylbenzoic acid
• CAS No.: 394655-10-8
• Molecular Formula: C11H15N3O2
• Molecular Weight: 221.26
• Hs Code.: 2933599090
• European Community (EC) Number: 630-037-3
• DSSTox Substance ID: DTXSID90377970
• Mol file: 394655-10-8.mol

Synonyms:3-amino-2-piperazin-1-ylbenzoic acid;394655-10-8;3-amino-2-(piperazin-1-yl)benzoic acid;Benzoic acid,3-amino-2-(1-piperazinyl)-;MFCD06245325;3-AMINO-2-PIPERAZIN-1-YLBENZOICACID;DTXSID90377970;AKOS005254772

Chemical Property of 3-Amino-2-piperazin-1-ylbenzoic acid

Chemical Property:

• Vapor Pressure: 4.35E-09mmHg at 25°C
• Refractive Index: 1.624
• Boiling Point: 455.5 °C at 760 mmHg
• Flash Point: 229.3 °C
• PSA: 78.59000
• Density: 1.282g/cm³
• LogP: 1.35160
• XLogP3: -2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 221.116426730
• Heavy Atom Count: 16
• Complexity: 254

Purity/Quality:

NLT 98% ^*data from raw suppliers

3-AMINO-2-PIPERAZIN-1-YLBENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)C2=C(C=CC=C2N)C(=O)O