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N-[2,2,2-trifluoro-1-(4-methylthiophen-2-yl)ethylidene]hydroxylamine

HCID 86757148
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1csc(C(=NO)C(F)(F)F)c1
InChIKey
SCGXFELGTVRNJR-UHFFFAOYSA-N
Molecular formula
C7H6F3NOS
Average molar mass
209.19 g/mol

Names & identifiers

Preferred name
N-[2,2,2-trifluoro-1-(4-methylthiophen-2-yl)ethylidene]hydroxylamine
IUPAC
N-[2,2,2-trifluoro-1-(4-methylthiophen-2-yl)ethylidene]hydroxylamine

Names & synonyms

SCHEMBL7246648SCGXFELGTVRNJR-UHFFFAOYSA-NN-[2,2,2-trifluoro-1-(4-methylthiophen-2-yl)ethylidene]hydroxylamine

Database identifiers

PubChem CID
86757148

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
60.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
13
Formal charge
0
Complexity
216

Related reactions

1 records
New reaction record
HRID 107692 reaction equation
HRID 107692As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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