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2,2,2-Trifluoro-n-pentylacetamide

HCID 580920
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
14618-15-6
Standard SMILES
CCCCCNC(=O)C(F)(F)F
InChIKey
RMWWLGNPNBPNDO-UHFFFAOYSA-N
Molecular formula
C7H12F3NO
Average molar mass
183.17 g/mol
Monoisotopic mass
183.08709849

Names & identifiers

Preferred name
2,2,2-Trifluoro-n-pentylacetamide
IUPAC
2,2,2-trifluoro-N-pentylacetamide
English name
2,2,2-Trifluoro-N-pentylacetamide
Molecular formula
C7H12F3NO
Molecular weight
183.17

Names & synonyms

2,2,2-Trifluoro-n-pentylacetamide14618-15-6DTXSID00342336RefChem:242541DTXCID60293416Acetamide, 2,2,2-trifluoro-N-pentyl-N-pentyl-trifluoroacetamideSCHEMBL1389225SCHEMBL4169588SCHEMBL7237512SCHEMBL77089132,2,2-Trifluoro-n-pentylacetamide #
Show more names
AKOS003864491

Database identifiers

CAS
14618-15-6
PubChem CID
580920
DTXSID
DTXSID00342336
Nikkaji
J113.659C

Properties

Computed structural propertiesFilling in

XLogP
2.4
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
144

Related reactions

2 records
New reaction record
HRID 837794 reaction equation
HRID 837794As reactantTest data from https://doi.org/10.1039/C8SC04228D
HRID 2413843 reaction equation
HRID 2413843As reactantuspto-grants-1988_01

Compound notes

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