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3'-Benzyloxybiphenyl-4-ylmethylamine

HCID 23005019
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
NCc1ccc(-c2cccc(OCc3ccccc3)c2)cc1
InChIKey
JNGRLOQPLXVGPM-UHFFFAOYSA-N
Molecular formula
C20H19NO
Average molar mass
289.4 g/mol

Names & identifiers

Preferred name
3'-Benzyloxybiphenyl-4-ylmethylamine
IUPAC
[4-(3-phenylmethoxyphenyl)phenyl]methanamine

Names & synonyms

SCHEMBL2570119JNGRLOQPLXVGPM-UHFFFAOYSA-N3'-Benzyloxybiphenyl-4-ylmethylamine3'-benzyloxy-biphenyl-4-ylmethylamineAKOS004117134

Database identifiers

PubChem CID
23005019

Properties

Computed structural propertiesFilling in

XLogP
3.9
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
305

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Related reactions

5 records
New reaction record
HRID 282665 reaction equation
HRID 282665As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 309963 reaction equation
HRID 309963As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 1713272 reaction equation
HRID 1713272As productuspto-grants-2010_09
HRID 1713296 reaction equation
HRID 1713296As reactantuspto-grants-2010_09
HRID 1713324 reaction equation
HRID 1713324As reactantuspto-grants-2010_09

Compound notes

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