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11-Bromo-tetrahydropyranyl undecanol (HCID 18936892)|Huagongshe
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Compound
11-Bromo-tetrahydropyranyl undecanol
HCID
18936892
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
OC(CCCCCCCCCCBr)C1CCCCO1
InChIKey
UHTOOVOGCFQMJG-UHFFFAOYSA-N
Molecular formula
C16H31BrO2
Average molar mass
335.32 g/mol
Names & identifiers
Preferred name
11-Bromo-tetrahydropyranyl undecanol
IUPAC
11-bromo-1-(oxan-2-yl)undecan-1-ol
Names & synonyms
SCHEMBL8654609
UHTOOVOGCFQMJG-UHFFFAOYSA-N
11-bromo-tetrahydropyranyl undecanol
Database identifiers
PubChem CID
18936892
Properties
Computed structural properties
XLogP
5.3
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
11
Heavy atoms
19
Formal charge
0
Complexity
199
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Related reactions
7 records
New reaction record
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
275529
As reactant
uspto-grants-1995_02
HRID
357323
As reactant
uspto-grants-1998_11
HRID
1081519
As reactant
uspto-grants-1996_12
HRID
1608736
As reactant
uspto-grants-1995_03
HRID
2141181
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID
2293641
As reactant
uspto-grants-1997_11
HRID
2380168
As reactant
uspto-grants-1994_11
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Compound notes
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