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2,3-Dichloro-N-phenethyl-maleimide

HCID 724952
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Basic information

CAS
3116-49-2
Standard SMILES
O=C1C(Cl)=C(Cl)C(=O)N1CCc1ccccc1
InChIKey
PEVIFCOPDASLPN-UHFFFAOYSA-N
Molecular formula
C12H9Cl2NO2
Average molar mass
270.11 g/mol
Monoisotopic mass
269.0010339

Names & identifiers

Preferred name
2,3-Dichloro-N-phenethyl-maleimide
IUPAC
3,4-dichloro-1-(2-phenylethyl)pyrrole-2,5-dione

Names & synonyms

3116-49-22,3-Dichloro-N-phenethyl-maleimide3,4-dichloro-1-phenethyl-1H-pyrrole-2,5-dione3,4-dichloro-1-(2-phenylethyl)-2,5-dihydro-1H-pyrrole-2,5-dione3,4-dichloro-1-(2-phenylethyl)-1H-pyrrole-2,5-dione3,4-DICHLORO-1-(2-PHENYLETHYL)PYRROLE-2,5-DIONEMFCD03109998Maleimide, 2,3-dichloro-N-phenethyl-starbld0046109SCHEMBL8066978CHEMBL1774736DTXSID00953249
Show more names
STL337076AKOS002256648NS-04328CS-0333160ST501963173,4-dichloro-1-(2-phenylethyl)azoline-2,5-dioneF3098-2151

Database identifiers

CAS
3116-49-2
PubChem CID
724952
DTXSID
DTXSID00953249
ChEMBL
CHEMBL1774736
Nikkaji
J958.740C

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
37.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
349

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