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Compound
3-(8-Phenyloctyloxy)-2-hydroxypropylazide
HCID
21474713
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
[N-]=[N+]=NCC(O)COCCCCCCCCc1ccccc1
InChIKey
FLBCREZLATVKLL-UHFFFAOYSA-N
Molecular formula
C17H27N3O2
Average molar mass
305.4 g/mol
Names & identifiers
Preferred name
3-(8-Phenyloctyloxy)-2-hydroxypropylazide
IUPAC
1-azido-3-(8-phenyloctoxy)propan-2-ol
Names & synonyms
FLBCREZLATVKLL-UHFFFAOYSA-N
3-(8-phenyloctyloxy)-2-hydroxypropylazide
Database identifiers
PubChem CID
21474713
Properties
Computed structural properties
XLogP
5.2
Topological polar surface area
43.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
13
Heavy atoms
22
Formal charge
0
Complexity
300
Show all 8
Show all 8 / 8
Related reactions
6 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
960181
As product
Validation data from https://doi.org/10.1039/C8SC04228D
HRID
1119361
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID
1901718
As product
uspto-grants-1996_11
HRID
1901719
As reactant
uspto-grants-1996_11
HRID
2294332
As product
uspto-grants-1997_11
HRID
2294333
As reactant
uspto-grants-1997_11
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Compound notes
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3-(8-Phenyloctyloxy)-2-hydroxypropylazide (HCID 21474713)|Huagongshe