Structure Info
- Chemspace ID
- CSSS00009863612 (In-Stock Screening Compounds)
- CAS
- 1253195-51-5, 69034-12-4
- MFCD
- MFCD16250159
- IUPAC Name
- 4,5-difluoro-2-methylbenzaldehyde
- Mol formula
- C8H6F2O
- Mol weight
- 156 Da
- Catalog Number(s)
- A010031196, AA02EDLR, AG02EDOJ, BBV-39749735, BO29947, CSC009863612, EN300-6767458, FCH1161818, PC99427, Y3315766, Z1255425782, ZX-NM308502, a6_12856_66097
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.48
- Heavy atoms count
- 11
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 17
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00009863612
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