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2-(4-Fluorophenoxy)acetamide

HCID 67623
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Basic information

CAS
332-50-3
Standard SMILES
NC(=O)COc1ccc(F)cc1
InChIKey
PNGGWQMSHKIEAF-UHFFFAOYSA-N
Molecular formula
C8H8FNO2
Average molar mass
169.15 g/mol
Monoisotopic mass
169.05390666

Names & identifiers

Preferred name
2-(4-Fluorophenoxy)acetamide
IUPAC
2-(4-fluorophenoxy)acetamide
English name
2-(4-fluorophenoxy)acetamide
Molecular formula
C8H8FNO2
Molecular weight
169.15

Names & synonyms

2-(4-Fluorophenoxy)acetamide332-50-3EINECS 206-365-4DTXSID90186847NSC 190773RefChem:84401DTXCID30109338206-365-4NSC-190773Acetamide,2-(4-fluorophenoxy)-p-fluorophenoxyacetamideacetamide, 2-(4-fluorophenoxy)-
Show more names
(4-Fluorophenoxy)acetamide
NSC1907734-fluorophenoxyacetamideVJ5KD52WEX2-(p-Fluorophenoxy)acetamideSCHEMBL1395812SCHEMBL11221136PNGGWQMSHKIEAF-UHFFFAOYSA-NMFCD00245827

Database identifiers

CAS
332-50-3
PubChem CID
67623
DTXSID
DTXSID90186847
UNII
VJ5KD52WEX
EC Number
206-365-4
Nikkaji
J193.764B

Properties

Computed structural properties

XLogP
1
Topological polar surface area
52.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
12
Formal charge
0
Complexity
155

Physicochemical properties

Melting point
109.5 · 109.5-110.5 °C
Boiling point
357.5 · 357.5±22.0 °C(Predicted)
Density
1.253 · 1.253±0.06 g/cm3(Predicted)
pka
16.66 · 16.66±0.40(Predicted)
FDA UNII
5 KD52WEX · VJ5KD52WEX
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P302+P352-P304+P340-P305+P351+P338
HS Code
2924297099 · 2924297099

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2924297099
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P302+P352-P304+P340-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Upstream raw materials

BromoacetonitrileChloroacetamide4-Fluorophenol4-Fluorobenzeneboronic acid

Related reactions

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Compound notes

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