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3-(2-Methylindazol-4-yl)prop-2-en-1-ol (HCID 66720641)|Huagongshe
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Compound
3-(2-Methylindazol-4-yl)prop-2-en-1-ol
HCID
66720641
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
Cn1cc2c(C=CCO)cccc2n1
InChIKey
WZOUVLCYOHQHPL-UHFFFAOYSA-N
Molecular formula
C11H12N2O
Average molar mass
188.23 g/mol
Names & identifiers
Preferred name
3-(2-Methylindazol-4-yl)prop-2-en-1-ol
IUPAC
3-(2-methylindazol-4-yl)prop-2-en-1-ol
Names & synonyms
SCHEMBL543348
Database identifiers
PubChem CID
66720641
Properties
Computed structural properties
XLogP
1.3
Topological polar surface area
38.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
217
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Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
294834
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID
689682
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
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