Aniline

Base Information

• Chemical Name: Aniline
• CAS No.: 18960-62-8
• 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: 94.1173
• 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: 18960-62-8.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:

• Melting Point: −6 °C(lit.)
• Refractive Index: n20/D 1.586(lit.)
• Boiling Point: 184 °C(lit.)
• Flash Point: 158 °F
• PSA: 26.02000
• Density: 1.033 g/mL at 25 °C
• LogP: 1.85000
• Storage Temp.: 2-8°C
• 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:

97% ^*data from raw suppliers

ANILINE-1-13C 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,N
• Statements: 20/21/22-40-48/23/24/25-50-68-43-41-23/24/25
• Safety Statements: 28-36/37-45-61-63-46-36/37/39-27-26

MSDS Files:

SDS file from LookChem

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.

Technology Process of Aniline

There total 1 articles about Aniline which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ (1-13C)-Anilin (18960-62-8)

Guidance literature:

Benzoesaeure-1-¹3Χ, NaN3;