4-(Isoindolin-2-yl)-2-methoxybenzaldehyde
Basic information
- CAS
347325-46-6- Standard SMILES
COc1cc(N2Cc3ccccc3C2)ccc1C=O- InChIKey
RWIGWDSWXVRXBV-UHFFFAOYSA-N- Molecular formula
- C16H15NO2
- Average molar mass
- 253.29 g/mol
- Monoisotopic mass
- 253.11027872
Names & identifiers
- Preferred name
- 4-(Isoindolin-2-yl)-2-methoxybenzaldehyde
- IUPAC
- 4-(1,3-dihydroisoindol-2-yl)-2-methoxybenzaldehyde
Names & synonyms
4-(Isoindolin-2-yl)-2-methoxybenzaldehyde347325-46-64-(1,3-dihydro-2H-isoindol-2-yl)-2-methoxybenzaldehyde4-(1,3-dihydroisoindol-2-yl)-2-methoxybenzaldehydeMLS001163460SMR0004971724-isoindolin-2-yl-2-methoxy-benzaldehydeCambridge id 6702972Oprea1_478646cid_806545CHEMBL1365827SCHEMBL17191288
Show more names
BDBM47999DTXSID001332210HMS2818C20STK365092AKOS000446801SB653424-isoindolin-2-yl-2-methoxybenzaldehydeCS-0374207
Database identifiers
- CAS
347325-46-6- PubChem CID
- 806545
- DTXSID
DTXSID001332210- ChEMBL
CHEMBL1365827
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 306
Experimental & physicochemical properties
Solubility1.8 [ug/mL] (The mean of the results at pH 7.4)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…