Structure Info
- Chemspace ID
- CSMB00015200410 (Enamine MADE)
- CAS
- 118546-18-2
- MFCD
- MFCD22587874
- IUPAC Name
- (3-propyloxetan-3-yl)methyl 4-iodobenzoate
- Mol formula
- C14H17IO3
- Mol weight
- 360 Da
- Catalog Number(s)
- AGNPC-0NZM6Q, BBV-55120013, BD00824613, CM577965, CS-0297232, CSC015200410, CUR-0098599, EN300-235509, F2147-1107, HY-W234763, JH80742, L18776, LN01275031, P235061
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.02
- Heavy atoms count
- 18
- Rotatable bond count
- 6
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00015200410
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