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6-Benzyloxy-1-[2-(tert-butyldimethyl-silanyloxy)-propyl]-1H-indazole

HCID 22496576
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(Cn1ncc2ccc(OCc3ccccc3)cc21)O[Si](C)(C)C(C)(C)C
InChIKey
TXZZEAPIVBWIHF-UHFFFAOYSA-N
Molecular formula
C23H32N2O2Si
Average molar mass
396.6 g/mol
Monoisotopic mass
396.2233048

Names & identifiers

Preferred name
6-Benzyloxy-1-[2-(tert-butyldimethyl-silanyloxy)-propyl]-1H-indazole
IUPAC
tert-butyl-dimethyl-[1-(6-phenylmethoxyindazol-1-yl)propan-2-yloxy]silane

Names & synonyms

SCHEMBL5787841TXZZEAPIVBWIHF-UHFFFAOYSA-N6-Benzyloxy-1-[2-(tert-butyidimethyl-silanyloxy)-propyl]-1H-indazole6-Benzyloxy-1-[2-(tert-butyldimethyl-silanyloxy)-propyl]-1H-indazole

Database identifiers

PubChem CID
22496576

Properties

Computed structural propertiesFilling in

Topological polar surface area
36.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
28
Formal charge
0
Complexity
487

Related reactions

8 records
New reaction record
HRID 89633 reaction equation
HRID 89633As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 213583 reaction equation
HRID 213583As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 947568 reaction equation
HRID 947568As reactantValidation data from https://doi.org/10.1039/C8SC04228D
HRID 1550136 reaction equation
HRID 1550136As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1815951 reaction equation
HRID 1815951As productuspto-grants-2005_04
HRID 1815952 reaction equation
HRID 1815952As reactantuspto-grants-2005_04
HRID 2121873 reaction equation
HRID 2121873As productuspto-grants-2004_02
HRID 2121874 reaction equation
HRID 2121874As reactantuspto-grants-2004_02

Compound notes

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