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Methyl 12-Methoxydodecanoate (HCID 19611779)|Huagongshe
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Compound
Methyl 12-Methoxydodecanoate
HCID
19611779
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
COCCCCCCCCCCCC(=O)OC
InChIKey
GHQJPVVANYTPDP-UHFFFAOYSA-N
Molecular formula
C14H28O3
Average molar mass
244.37 g/mol
Names & identifiers
Preferred name
Methyl 12-Methoxydodecanoate
IUPAC
methyl 12-methoxydodecanoate
Names & synonyms
Methyl 12-Methoxydodecanoate
SCHEMBL8467495
GHQJPVVANYTPDP-UHFFFAOYSA-N
Database identifiers
PubChem CID
19611779
Nikkaji
J2.053.943G
Properties
Computed structural properties
XLogP
4.2
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
13
Heavy atoms
17
Formal charge
0
Complexity
169
Show all 8
Show all 8 / 8
Related reactions
10 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
342720
As product
uspto-grants-1999_01
HRID
583213
As product
uspto-grants-1999_07
HRID
618304
As product
uspto-grants-1999_09
HRID
862981
As product
uspto-grants-1998_02
HRID
1379261
As product
uspto-grants-1997_09
HRID
1379925
As product
uspto-grants-1997_09
HRID
1449765
As product
uspto-grants-1997_02
HRID
1553971
As product
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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