Basic information
- Standard SMILES
O=C/C=C/c1cc2cc(Cl)ccc2[nH]1- InChIKey
MVYVVIUDYHYJLD-OWOJBTEDSA-N- Molecular formula
- C11H8ClNO
- Average molar mass
- 205.64 g/mol
Names & identifiers
- Preferred name
- 3-(5-chloro-1H-indol-2-yl)prop-2-enal
- IUPAC
- (E)-3-(5-chloro-1H-indol-2-yl)prop-2-enal
Names & synonyms
3-(5-chloro-1H-indol-2-yl)prop-2-enal180868-89-7SCHEMBL8350514MVYVVIUDYHYJLD-OWOJBTEDSA-N(E)-3-(5-Chloro-2-indolyl)-2-propenaldehydeEN300-1981530
Database identifiers
- PubChem CID
- 19610409
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 241
Related reactions
1 records
Compound notes
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