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1-(4-chlorophenyl)-2-(1-trityl-1H-imidazol-2-yl)ethanol

HCID 57750313
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
OC(Cc1nccn1C(c1ccccc1)(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1
InChIKey
WTDSUUFDSKABQL-UHFFFAOYSA-N
Molecular formula
C30H25ClN2O
Average molar mass
465 g/mol
Monoisotopic mass
464.1655411

Names & identifiers

Preferred name
1-(4-chlorophenyl)-2-(1-trityl-1H-imidazol-2-yl)ethanol
IUPAC
1-(4-chlorophenyl)-2-(1-tritylimidazol-2-yl)ethanol

Names & synonyms

SCHEMBL392084WTDSUUFDSKABQL-UHFFFAOYSA-N1-(4-chlorophenyl)-2-(1-trityl-1H-imidazol-2-yl)ethanol

Database identifiers

PubChem CID
57750313

Properties

Computed structural propertiesFilling in

XLogP
6.6
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
7
Heavy atoms
34
Formal charge
0
Complexity
557

Related reactions

4 records
New reaction record
HRID 106493 reaction equation
HRID 106493As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 196390 reaction equation
HRID 196390As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 423098 reaction equation
HRID 423098As productuspto-grants-2012_01
HRID 423099 reaction equation
HRID 423099As reactantuspto-grants-2012_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes