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N-(4-cyanophenyl)-2,2,2-trifluoroacetamide

HCID 690600
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Basic information

CAS
62926-88-9
Standard SMILES
N#Cc1ccc(NC(=O)C(F)(F)F)cc1
InChIKey
VPJKIULOCQCMPV-UHFFFAOYSA-N
Molecular formula
C9H5F3N2O
Average molar mass
214.14 g/mol
Monoisotopic mass
214.03539727

Names & identifiers

Preferred name
N-(4-cyanophenyl)-2,2,2-trifluoroacetamide
IUPAC
N-(4-cyanophenyl)-2,2,2-trifluoroacetamide
English name
AcetaMide, N-(4-cyanophenyl)-2,2,2-trifluoro-
Molecular formula
C9H5F3N2O
Molecular weight
214.14

Names & synonyms

N-(4-cyanophenyl)-2,2,2-trifluoroacetamide62926-88-9Acetamide, N-(4-cyanophenyl)-2,2,2-trifluoro-SCHEMBL5785443DTXSID70351091HMS1787P05STK029788AKOS000485945HS-5042ST008956AG-205/10276055Z56968163
Show more names
N-(4-cyanophenyl)-alpha, alpha, alpha-trifluoroacetoamide

Database identifiers

CAS
62926-88-9
PubChem CID
690600
DTXSID
DTXSID70351091
Nikkaji
J1.105.105G

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
52.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
283

Related reactions

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Compound notes

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