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4-(4-Phenylbutoxy)aniline

HCID 20074038
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Basic information

CAS
57327-75-0
Standard SMILES
Nc1ccc(OCCCCc2ccccc2)cc1
InChIKey
JQJDCYNTROSRNS-UHFFFAOYSA-N
Molecular formula
C16H19NO
Average molar mass
241.33 g/mol
Monoisotopic mass
241.14666423

Names & identifiers

Preferred name
4-(4-Phenylbutoxy)aniline
IUPAC
4-(4-phenylbutoxy)aniline

Names & synonyms

4-(4-PHENYLBUTOXY)ANILINE57327-75-0SCHEMBL3083461DTXSID40602163

Database identifiers

CAS
57327-75-0
PubChem CID
20074038
DTXSID
DTXSID40602163

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
18
Formal charge
0
Complexity
205

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Related reactions

1 records
New reaction record
HRID 804057 reaction equation
HRID 804057As reactantTest data from https://doi.org/10.1039/C8SC04228D

Compound notes

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