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1,2-Bis(4-chlorophenyl)-5-methylpyrrole

HCID 456917
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1
InChIKey
IQHZDSSQHQLNSG-UHFFFAOYSA-N
Molecular formula
C17H13Cl2N
Average molar mass
302.2 g/mol

Names & identifiers

Preferred name
1,2-Bis(4-chlorophenyl)-5-methylpyrrole
IUPAC
1,2-bis(4-chlorophenyl)-5-methylpyrrole

Names & synonyms

1,2-Bis(4-chlorophenyl)-5-methylpyrrole1,2-Bis(4-chlorophenyl)-5-methyl-1H-pyrroleSCHEMBL2961956IQHZDSSQHQLNSG-UHFFFAOYSA-N1,2-bis(4-chlorophenyl)-5-methyl-pyrrole1,2-bis-(4-chlorophenyl)-5-methylpyrrole

Database identifiers

PubChem CID
456917
Nikkaji
J518.430D

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
4.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
306

Related reactions

5 records
New reaction record
HRID 180737 reaction equation
HRID 180737As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 638797 reaction equation
HRID 638797As productuspto-grants-2010_04
HRID 638798 reaction equation
HRID 638798As reactantuspto-grants-2010_04
HRID 2357713 reaction equation
HRID 2357713As productuspto-grants-2010_07
HRID 2357714 reaction equation
HRID 2357714As reactantuspto-grants-2010_07

Compound notes

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