Acetamide, N-(2,4-difluorophenyl)-
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Basic information
- CAS
399-36-0- Standard SMILES
CC(=O)Nc1ccc(F)cc1F- InChIKey
WOHLPEUHFSHZAN-UHFFFAOYSA-N- Molecular formula
- C8H7F2NO
- Average molar mass
- 171.14 g/mol
- Monoisotopic mass
- 171.04957028
Overview
N1-(2,4-difluorophenyl)acetamide is an organofluorine compound.
Names & identifiers
- Preferred name
- Acetamide, N-(2,4-difluorophenyl)-
- IUPAC
- N-(2,4-difluorophenyl)acetamide
- English name
- 2,4-Difluoroacetanilide
- Molecular formula
- C8H7F2NO
- Molecular weight
- 171.14
Names & synonyms
N-(2,4-Difluorophenyl)acetamide399-36-02',4'-DifluoroacetanilideAcetamide, N-(2,4-difluorophenyl)-Acetanilide, 2',4'-difluoro-DTXSID00192939NSC 51780RefChem:314953DTXCID90115430609-757-72,4-difluoroacetanilideMFCD00032502
Show more names
SKL784Compound Fr121342',4'-Difluoroacetanilide>2,4-Difluorophenyl acetamide2',4'-Difluoroacetanilide99%2',4'-Difluoroacetanilide 99%
2,4-difluorophenyl acetamideMaybridge1_001023N-acetyl-2,4-difluoroanilineAcetamide,N-(2,4-difluorophenyl)-AKOS003887313Aminobenzene, N-acetyl-2,4-difluoro-CS-0128941D3578
Database identifiers
- CAS
399-36-0- PubChem CID
- 96093
- DTXSID
DTXSID00192939- ChEBI
CHEBI:195012- EC Number
- 609-757-7
- Nikkaji
- J1.542.492C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.4
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 122 · 122-124°C
- Boiling point
- 276.8 · 276.8±30.0 °C(Predicted)
- Density
- 1.307 · 1.307±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 13.02 · 13.02±0.70(Predicted)
- form
- powder to crystal
- color
- White to Light yellow to Purple
- BRN
- 2832300 · 2832300
- CAS DataBase Reference
- 399 · 399-36-0(CAS DataBase Reference)
- NIST Chemistry Reference
- Acetamide,N-(2,4-difluorophenyl)-(399-36-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (84.4%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (84.4%)
Safety data
- hs_code
- 2924297099
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Downstream products
Additional notes
DefinitionChEBI: N1-(2,4-difluorophenyl)acetamide is an organofluorine compound.
Related reactions
3 records
Compound notes
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