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[2-(1H-pyrazol-5-yl)phenyl]methanamine (HCID 178509656)|Huagongshe
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Compound
[2-(1H-pyrazol-5-yl)phenyl]methanamine
HCID
178509656
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Basic information
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Compound notes
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Basic information
Standard SMILES
NCc1ccccc1-c1cc[nH]n1
InChIKey
DYYVPJJPISKMEZ-UHFFFAOYSA-N
Molecular formula
C10H11N3
Average molar mass
173.21 g/mol
Monoisotopic mass
173.09529736
Names & identifiers
Preferred name
[2-(1H-pyrazol-5-yl)phenyl]methanamine
IUPAC
[2-(1H-pyrazol-5-yl)phenyl]methanamine
Names & synonyms
SCHEMBL8184427
SCHEMBL27606316
SCHEMBL27617982
SCHEMBL30332563
Database identifiers
PubChem CID
11446610
Properties
Computed structural properties
XLogP
0.7
Topological polar surface area
54.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
160
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Related reactions
1 records
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As product
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As solvent
HRID
702176
As product
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Compound notes
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