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N-Methoxy-N-methyl-2-(1,1,1-trifluorobut-3-en-2-yloxy)acetamide

HCID 86668366
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
C=CC(OCC(=O)N(C)OC)C(F)(F)F
InChIKey
HEKLDVKMLIDKEJ-UHFFFAOYSA-N
Molecular formula
C8H12F3NO3
Average molar mass
227.18 g/mol

Names & identifiers

Preferred name
N-Methoxy-N-methyl-2-(1,1,1-trifluorobut-3-en-2-yloxy)acetamide
IUPAC
N-methoxy-N-methyl-2-(1,1,1-trifluorobut-3-en-2-yloxy)acetamide

Names & synonyms

N-Methoxy-N-methyl-2-(1,1,1-trifluorobut-3-en-2-yloxy)acetamideSCHEMBL991129DB-0852851388149-59-4

Database identifiers

PubChem CID
86668366

Properties

Computed structural propertiesFilling in

XLogP
1.4
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
15
Formal charge
0
Complexity
230

Related reactions

10 records
New reaction record
HRID 173767 reaction equation
HRID 173767As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1152857 reaction equation
HRID 1152857As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1429646 reaction equation
HRID 1429646As productuspto-grants-2015_01
HRID 1429647 reaction equation
HRID 1429647As reactantuspto-grants-2015_01
HRID 2045874 reaction equation
HRID 2045874As productuspto-grants-2013_11
HRID 2045875 reaction equation
HRID 2045875As reactantuspto-grants-2013_11
HRID 2155165 reaction equation
HRID 2155165As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2195787 reaction equation
HRID 2195787As productuspto-grants-2012_12
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Compound notes

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