Basic information
- CAS
109347-41-3- Standard SMILES
O=CCc1ccccc1I- InChIKey
ZMOIBLKIUKDUFP-UHFFFAOYSA-N- Molecular formula
- C8H7IO
- Average molar mass
- 246.04 g/mol
- Monoisotopic mass
- 245.95416
Names & identifiers
- Preferred name
- 2-(2-Iodophenyl)acetaldehyde
- IUPAC
- 2-(2-iodophenyl)acetaldehyde
Names & synonyms
2-(2-iodophenyl)acetaldehyde109347-41-3benzeneacetaldehyde, 2-iodo-(2-iodophenyl)acetaldehydeo-JodphenylacetaldehydSCHEMBL3246427SCHEMBL5163205DTXSID30348705MFCD12031768SY411460CS-0380558EN300-109544
Show more names
InChI=1/C8H7IO/c9-8-4-2-1-3-7(8)5-6-10/h1-4,6H,5H
Database identifiers
- CAS
109347-41-3- PubChem CID
- 640203
- DTXSID
DTXSID30348705- Nikkaji
- J826.592E
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 114
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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