N-(5-Bromo-2-(trifluoromethoxy)phenyl)acetamide

HCID 3603102
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Basic information

CAS
392726-69-1
Standard SMILES
CC(=O)Nc1cc(Br)ccc1OC(F)(F)F
InChIKey
LKKZGGNYYLEERH-UHFFFAOYSA-N
Molecular formula
C9H7BrF3NO2
Average molar mass
298.06 g/mol
Monoisotopic mass
296.96122522

Names & identifiers

Preferred name
N-(5-Bromo-2-(trifluoromethoxy)phenyl)acetamide
IUPAC
N-[5-bromo-2-(trifluoromethoxy)phenyl]acetamide
English name
LABOTEST-BB LT01143471
Molecular formula
C9H7BrF3NO2
Molecular weight
298.06

Names & synonyms

392726-69-1N-(5-Bromo-2-(trifluoromethoxy)phenyl)acetamideN-ACETYL 5-BROMO-2-(TRIFLUOROMETHOXY)ANILINEN-[5-bromo-2-(trifluoromethoxy)phenyl]acetamideMFCD02317366SCHEMBL1527189DTXSID50394062LABOTEST-BB LT01143471SBB058427AKOS015837990BS-28202CS-0084365
Show more names
2-acetamido-5-bromo-1-trifluoromethoxybenzeneACETAMIDE, N-[5-BROMO-2-(TRIFLUOROMETHOXY)PHENYL]-
D74507N-(5-bromo-2-trifluoromethoxy-phenyl)-acetamide

Database identifiers

CAS
392726-69-1
PubChem CID
3603102
DTXSID
DTXSID50394062

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
16

Physicochemical properties

Boiling point
306.7 · 306.7±42.0 °C(Predicted)
Density
1.664 · 1.664±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
13.4 · 13.40±0.70(Predicted)

Chemistry & industry

Suppliers16 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]

Related reactions

10 records
New reaction record

Compound notes

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