Acetamide, N-(2,4-difluorophenyl)-

HCID 96093CAS 399-36-0
Substructure searchFind similar structures

Basic information

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 properties

XLogP
1.4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
12

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

Safety & regulation

GHS classification

GHS Classification · 4 items

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

Chemistry & industry

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Zhuanglai Chemical Trading Co Ltd+86-16264648883 · [email protected]
焦作沃恩生物科技有限责任公司0391-3702345 18739121806

Additional notes

DefinitionChEBI: N1-(2,4-difluorophenyl)acetamide is an organofluorine compound.

Related reactions

3 records
New reaction record

Linked notes

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