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4-Cyclohexyl-1-diazopentan-2-one (HCID 54520191)|Huagongshe
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Compound
4-Cyclohexyl-1-diazopentan-2-one
HCID
54520191
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Basic information
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Compound notes
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Basic information
Standard SMILES
CC(CC(=O)C=[N+]=[N-])C1CCCCC1
InChIKey
YPGHOTVBNHGHKJ-UHFFFAOYSA-N
Molecular formula
C11H18N2O
Average molar mass
194.27 g/mol
Monoisotopic mass
194.1419132
Names & identifiers
Preferred name
4-Cyclohexyl-1-diazopentan-2-one
IUPAC
4-cyclohexyl-1-diazopentan-2-one
Names & synonyms
SCHEMBL11082550
Database identifiers
PubChem CID
54520191
Properties
Computed structural properties
XLogP
3.4
Topological polar surface area
19.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
238
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Related reactions
1 records
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As solvent
HRID
105696
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Compound notes
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