N-Ethyl-4-methyl-N-phenylbenzenesulfonamide

HCID 74568
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Basic information

CAS
1821-40-5
Standard SMILES
CCN(c1ccccc1)S(=O)(=O)c1ccc(C)cc1
InChIKey
IXLBWOFLBSGRAP-UHFFFAOYSA-N
Molecular formula
C15H17NO2S
Average molar mass
275.4 g/mol
Monoisotopic mass
275.09799996

Names & identifiers

Preferred name
N-Ethyl-4-methyl-N-phenylbenzenesulfonamide
IUPAC
N-ethyl-4-methyl-N-phenylbenzenesulfonamide
English name
N-ethyl-4-methyl-N-phenyl-benzenesulfonamide
Molecular formula
C15H17NO2S
Molecular weight
275.37

Names & synonyms

N-Ethyl-4-methyl-N-phenylbenzenesulfonamide1821-40-5p-Toluenesulfonanilide, N-ethyl-DTXSID00171249RefChem:1091758DTXCID2093740N-Ethyl-4-methyl-N-phenyl-benzenesulfonamideN-ethyl-4-methyl-N-phenylbenzene-1-sulfonamideN-Ethyl-N-phenyl-p-toluenesulfonamideBENZENESULFONAMIDE, N-ETHYL-4-METHYL-N-PHENYL-N-Ethyl-p-toluenesulfonanilideBRN 2219716
Show more names
N-ethyl-toluene-4-sulfonanilide
AI3-30018TimTec1_000940Oprea1_145673Oprea1_7651854-12-00-01066 (Beilstein Handbook Reference)SCHEMBL5604160HMS1536K16STK094927

Database identifiers

CAS
1821-40-5
PubChem CID
74568
DTXSID
DTXSID00171249
Nikkaji
J123.435H

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
45.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
19

Physicochemical properties

Melting point
88 °C · 88 °C
Boiling point
404.4 · 404.4±38.0 °C(Predicted)
Density
1 · 1+-.0.06 g/cm3(Predicted)
pka
-1.61 · -1.61±0.50(Predicted)
CAS DataBase Reference
1821 · 1821-40-5

Chemistry & industry

Upstream & downstream products

Upstream raw materials

Suppliers3 total

武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
广州市金华大化学试剂有限公司020-84383047 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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