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Compound
2-Oxopropanal isopropylhydrazone
HCID
86650487
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CC(=O)C=NNC(C)C
InChIKey
YZIHUNZXNYQKDM-UHFFFAOYSA-N
Molecular formula
C6H12N2O
Average molar mass
128.17 g/mol
Names & identifiers
Preferred name
2-Oxopropanal isopropylhydrazone
IUPAC
1-(propan-2-ylhydrazinylidene)propan-2-one
Names & synonyms
2-oxopropanal isopropylhydrazone
SCHEMBL1144193
YZIHUNZXNYQKDM-UHFFFAOYSA-N
Database identifiers
PubChem CID
86650487
Properties
Computed structural properties
XLogP
1.6
Topological polar surface area
41.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
9
Formal charge
0
Complexity
118
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
115609
As product
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID
1880329
As product
uspto-grants-2012_11
Compound notes
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