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N-(n-propyl)trichloroacetamide (HCID 4287575)|Huagongshe
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Compound
N-(n-propyl)trichloroacetamide
HCID
4287575
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCCNC(=O)C(Cl)(Cl)Cl
InChIKey
LNJATJLPJBTZBD-UHFFFAOYSA-N
Molecular formula
C5H8Cl3NO
Average molar mass
204.48 g/mol
Names & identifiers
Preferred name
N-(n-propyl)trichloroacetamide
IUPAC
2,2,2-trichloro-N-propylacetamide
Names & synonyms
N-(n-propyl)trichloroacetamide
SCHEMBL2797759
LNJATJLPJBTZBD-UHFFFAOYSA-N
AKOS003846608
Database identifiers
PubChem CID
4287575
Properties
Computed structural properties
XLogP
2.3
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
10
Formal charge
0
Complexity
121
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
86307
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
2043080
As reactant
uspto-grants-2013_11
HRID
2394459
As reactant
uspto-grants-1998_09
Compound notes
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