Aniline

Base Information

• Chemical Name: Aniline
• CAS No.: 97862-10-7
• Deprecated CAS: 146997-94-6,37342-16-8,1533423-51-6,1582784-51-7,1619933-02-6,37342-16-8
• Molecular Formula: C6H7N
• Molecular Weight: 93.12648
• European Community (EC) Number: 200-539-3,294-999-2,308-052-9,686-085-0
• ICSC Number: 0011
• UN Number: 1547
• UNII: SIR7XX2F1K
• DSSTox Substance ID: DTXSID8020090
• Nikkaji Number: J2.349C
• Wikipedia: Aniline
• Wikidata: Q186414,Q27121173,Q83081722
• Metabolomics Workbench ID: 38235
• ChEMBL ID: CHEMBL538
• Mol file: 97862-10-7.mol

Synonyms:aniline;aniline aluminium salt;aniline dihydrofluoride;aniline diphosphate (1:1);aniline diphosphate (3:1);aniline diphosphate (4:1);aniline hydrobromide;aniline hydrochloride;aniline hydrochloride-(14)C-labeled cpd;aniline hydrochloride-(15)N-labeled cpd;aniline hydrofluoride;aniline hydrogen iodide;aniline monosulfate;aniline nitrate;aniline perchlorate;aniline phosphate (1:1);aniline phosphate (1:2);aniline phosphate (2:1);aniline phosphonate (1:1);aniline sulfate;aniline sulfate (2:1);aniline sulfate (2:1), (14)C-labeled cpd;aniline, (13)C-labeled cpd;aniline, (14)C-labeled cpd;aniline, 15N-labeled cpd;aniline, 2-(13)C-labeled cpd;aniline, 3-(13)C-labeled cpd;aniline, 3H-labeled cpd;aniline, 4-(13)C-labeled cpd;aniline, conjugate acid;aniline, ion(1+);aniline, magnesium (1:1) salt;aniline, monolithium salt;aniline, sodium salt

Chemical Property of Aniline

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 93.057849228
• Heavy Atom Count: 7
• Complexity: 46.1
• Transport DOT Label: Poison

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aromatic
• Canonical SMILES: C1=CC=C(C=C1)N
• Inhalation Risk: A harmful contamination of the air will be reached on evaporation of this substance at 20 °C; on spraying or dispersing, however, much faster.
• Effects of Short Term Exposure: The substance is severely irritating to the eyes. The substance may cause effects on the blood. This may result in the formation of methaemoglobin. Exposure could cause haemolysis. This may result in haemolytic anaemia. The effects may be delayed. Medical observation is indicated.
• Effects of Long Term Exposure: Repeated or prolonged contact may cause skin sensitization. The substance may have effects on the blood. This may result in haemolytic anaemia.