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2-butoxy-N-methoxy-N-methyl-4-trifluoromethyl-benzamide

HCID 86649967
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCCOc1cc(C(F)(F)F)ccc1C(=O)N(C)OC
InChIKey
SUVQLBZQRBBLOD-UHFFFAOYSA-N
Molecular formula
C14H18F3NO3
Average molar mass
305.29 g/mol
Monoisotopic mass
305.12387792

Names & identifiers

Preferred name
2-butoxy-N-methoxy-N-methyl-4-trifluoromethyl-benzamide
IUPAC
2-butoxy-N-methoxy-N-methyl-4-(trifluoromethyl)benzamide

Names & synonyms

2-butoxy-N-methoxy-N-methyl-4-trifluoromethyl-benzamideSCHEMBL955308

Database identifiers

PubChem CID
86649967

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
21
Formal charge
0
Complexity
336

Related reactions

4 records
New reaction record
HRID 150554 reaction equation
HRID 150554As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1042487 reaction equation
HRID 1042487As productuspto-grants-2013_10
HRID 1042488 reaction equation
HRID 1042488As reactantuspto-grants-2013_10
HRID 1570146 reaction equation
HRID 1570146As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes