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2-Methanesulfonyloxynonane (HCID 14916006)|Huagongshe
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Compound
2-Methanesulfonyloxynonane
HCID
14916006
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCCCCCCC(C)OS(C)(=O)=O
InChIKey
QKPWQFFVHCWCHM-UHFFFAOYSA-N
Molecular formula
C10H22O3S
Average molar mass
222.35 g/mol
Names & identifiers
Preferred name
2-Methanesulfonyloxynonane
IUPAC
nonan-2-yl methanesulfonate
Names & synonyms
2-methanesulfonyloxynonane
SCHEMBL8844066
QKPWQFFVHCWCHM-UHFFFAOYSA-N
Database identifiers
PubChem CID
14916006
Properties
Computed structural properties
XLogP
3.5
Topological polar surface area
51.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
14
Formal charge
0
Complexity
216
Show all 8
Show all 8 / 8
Related reactions
6 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
53481
As reactant
uspto-grants-1997_04
HRID
202637
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
974743
As reactant
uspto-grants-1997_03
HRID
1034382
As reactant
uspto-grants-1994_05
HRID
1728283
As reactant
uspto-grants-1994_07
HRID
1733761
As reactant
uspto-grants-1996_07
Show 2 more
Compound notes
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