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1-(Para-fluorophenyl)-3-(acetamido)propane

HCID 58997658
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(=O)NCCCc1ccc(F)cc1
InChIKey
VIPHDKAJRACYMV-UHFFFAOYSA-N
Molecular formula
C11H14FNO
Average molar mass
195.23 g/mol

Names & identifiers

Preferred name
1-(Para-fluorophenyl)-3-(acetamido)propane
IUPAC
N-[3-(4-fluorophenyl)propyl]acetamide

Names & synonyms

SCHEMBL5378328VIPHDKAJRACYMV-UHFFFAOYSA-N1-(para-fluorophenyl)-3-(acetamido)propane

Database identifiers

PubChem CID
58997658

Properties

Computed structural properties

XLogP
2
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
176

Related reactions

3 records
New reaction record
HRID 1210683 reaction equation
HRID 1210683As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1592353 reaction equation
HRID 1592353As productuspto-grants-2007_11
HRID 1592354 reaction equation
HRID 1592354As reactantuspto-grants-2007_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes