4-((4-Aminophenyl)ethylamino)butane-1-sulphonic acid

Base Information

• Chemical Name: 4-((4-Aminophenyl)ethylamino)butane-1-sulphonic acid
• CAS No.: 84434-67-3
• Molecular Formula: C12H20 N2 O3 S
• Molecular Weight: 272.3638
• European Community (EC) Number: 282-868-2
• DSSTox Substance ID: DTXSID701004705
• Nikkaji Number: J297.705B
• Wikidata: Q82999825
• Mol file: 84434-67-3.mol

Synonyms:84434-67-3;EINECS 282-868-2;4-((4-Aminophenyl)ethylamino)butane-1-sulphonic acid;SCHEMBL11152893;JPGJBDBLHLPCNM-UHFFFAOYSA-N;4-[(4-AMINOPHENYL)ETHYLAMINO]BUTANE-1-SULFONIC ACID;DTXSID701004705;NS00060907;4-[(4-Aminophenyl)(ethyl)amino]butane-1-sulfonic acid

Chemical Property of 4-((4-Aminophenyl)ethylamino)butane-1-sulphonic acid

Chemical Property:

• PSA: 100.80000
• Density: 1.245g/cm³
• LogP: 3.12180
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 7
• Exact Mass: 272.11946368
• Heavy Atom Count: 18
• Complexity: 319

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CCCCS(=O)(=O)O)C1=CC=C(C=C1)N