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3-[2-(10,11-Dihydro-dibenzo[a,d]cyclohepten-5-ylidenemethyl)-phenyl]-pyridine

HCID 57736591
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
C(=C1c2ccccc2CCc2ccccc21)c1ccccc1-c1cccnc1
InChIKey
USHOWTSTEKSBTQ-UHFFFAOYSA-N
Molecular formula
C27H21N
Average molar mass
359.5 g/mol

Names & identifiers

Preferred name
3-[2-(10,11-Dihydro-dibenzo[a,d]cyclohepten-5-ylidenemethyl)-phenyl]-pyridine
IUPAC
3-[2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenylidenemethyl)phenyl]pyridine

Names & synonyms

SCHEMBL4167632USHOWTSTEKSBTQ-UHFFFAOYSA-N3-[2-(10,11-Dihydro-dibenzo[a,d]cyclohepten-5-ylidenemethyl)-phenyl]-pyridine

Database identifiers

PubChem CID
57736591

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
28
Formal charge
0
Complexity
510

Related reactions

2 records
New reaction record
HRID 307147 reaction equation
HRID 307147As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 2218720 reaction equation
HRID 2218720As productuspto-grants-2008_08

Compound notes

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