N-Thionylaniline

Base Information

• Chemical Name: N-Thionylaniline
• CAS No.: 1122-83-4
• Molecular Formula: C6H5 N O S
• Molecular Weight: 139.18
• Hs Code.: 29299090
• European Community (EC) Number: 214-362-4
• NSC Number: 40228
• UNII: SV7R5HC44R
• DSSTox Substance ID: DTXSID0061533
• Nikkaji Number: J110.516G
• Wikipedia: N-Sulfinylaniline
• Wikidata: Q21099664
• Mol file: 1122-83-4.mol

Synonyms:N-Thionylaniline;1122-83-4;N-Sulfinylaniline;Benzenamine, N-sulfinyl-;Thionylaniline;(sulfinylamino)benzene;Aniline, N-sulfinyl-;Phenylsulfinylamine;Sulfinylphenylamine;Phenylthionylamine;Thionyl imide, phenyl-;Sulfurous imide, phenyl-;N-Sulfinylbenzenamine;N-Sulphinylaniline;NSC 40228;N-Sulfinylaniline, Pract.;SV7R5HC44R;EINECS 214-362-4;n-(oxo-lambda4-sulfanylidene)aniline;NSC-40228;AI3-22597;C6H5NOS;(N(E))-N-Sulfinylbenzenamine;[N(E)]-N-Sulfinylbenzenamine;Benzenamine, N-sulfinyl-, (N(E))-;Benzenamine, N-sulfinyl-, [N(E)]-;N-THIONYL ANILINE;sulfinylaniline;Thionylanilin;N-Sulfinyl-aniline;NSC40228;Sulfilimine, phenyl;(sulfinylamino)-benzene;N-Thionylaniline, 98%;N-Thionylaniline, Pract.;UNII-SV7R5HC44R;(phenylimino)-l4-sulfanone;N-Phenyl-N-sulfinylamine #;SCHEMBL377094;BENZENAMINE,N-SULFINYL-;DTXSID0061533;C6-H5-N-O-S;AMY31360;MFCD00002084;AKOS009028976;N-Phenyl-N-sulfinylamine;CS-0179360;FT-0676070;T0215;EN300-19238;A19736;H11314;J-002743;222851-56-1

Chemical Property of N-Thionylaniline

Chemical Property:

• Vapor Pressure: 0.469mmHg at 25°C
• Refractive Index: n20/D 1.627(lit.)
• Boiling Point: 200°Cat760mmHg
• Flash Point: 84.4°C
• PSA: 61.52000
• Density: 1.19g/cm³
• LogP: 2.58040
• Water Solubility.: Partly miscible in water.
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 139.00918496
• Heavy Atom Count: 9
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

N-Thionylaniline >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 36/37/38-42/43
• Safety Statements: 26-36-45-23

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)N=S=O
• Uses: Versatile synthetic intermediate. It is a versatile synthetic intermediate and an active pharmaceutical intermediate.