Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
1h-Indole,7-(4-ethylphenyl)- (HCID 22048867)|Huagongshe
Home
/
Compound
1h-Indole,7-(4-ethylphenyl)-
HCID
22048867
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
CCc1ccc(-c2cccc3cc[nH]c23)cc1
InChIKey
AKSHZQYYNHTWPD-UHFFFAOYSA-N
Molecular formula
C16H15N
Average molar mass
221.3 g/mol
Names & identifiers
Preferred name
1h-Indole,7-(4-ethylphenyl)-
IUPAC
7-(4-ethylphenyl)-1H-indole
Names & synonyms
1h-indole,7-(4-ethylphenyl)-
487058-39-9
7-(4-ethylphenyl)-1H-indole
SCHEMBL5659443
AKSHZQYYNHTWPD-UHFFFAOYSA-N
Database identifiers
PubChem CID
22048867
Properties
Computed structural properties
XLogP
4.6
Topological polar surface area
15.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
242
Show all 8
Show all 8 / 8
Related reactions
3 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
92691
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
1832653
As product
uspto-grants-2006_06
HRID
2087647
As product
uspto-grants-2004_04
Compound notes
Loading…