4-{4-[(4-Fluoroanilino)methyl]-5-hydroxypent-1-en-1-yl}phenol
Basic information
- CAS
927833-13-4- Standard SMILES
OCC(CC=Cc1ccc(O)cc1)CNc1ccc(F)cc1- InChIKey
VWRZPRVMIKCOTJ-UHFFFAOYSA-N- Molecular formula
- C18H20FNO2
- Average molar mass
- 301.4 g/mol
- Monoisotopic mass
- 301.14780704
Names & identifiers
- Preferred name
- 4-{4-[(4-Fluoroanilino)methyl]-5-hydroxypent-1-en-1-yl}phenol
- IUPAC
- 4-[4-[(4-fluoroanilino)methyl]-5-hydroxypent-1-enyl]phenol
Names & synonyms
927833-13-4DTXSID708538084-{4-[(4-Fluoroanilino)methyl]-5-hydroxypent-1-en-1-yl}phenol
Database identifiers
- CAS
927833-13-4- PubChem CID
- 71445239
- DTXSID
DTXSID70853808
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 52.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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