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5-(1-Adamantyl)-3-((dimethylamino)methyl)(1,1'-biphenyl)-2-ol

HCID 285587
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Basic information

CAS
35839-44-2
Standard SMILES
CN(C)Cc1cc(C23CC4CC(CC(C4)C2)C3)cc(-c2ccccc2)c1O
InChIKey
FKVFOPFHCHWVFU-UHFFFAOYSA-N
Molecular formula
C25H31NO
Average molar mass
361.5 g/mol
Monoisotopic mass
361.24056461

Names & identifiers

Preferred name
5-(1-Adamantyl)-3-((dimethylamino)methyl)(1,1'-biphenyl)-2-ol
IUPAC
4-(1-adamantyl)-2-[(dimethylamino)methyl]-6-phenylphenol
English name
5-(1-Adamantyl)-3-((dimethylamino)methyl)(1,1'-biphenyl)-2-ol
Molecular formula
C25H31NO
Molecular weight
0

Names & synonyms

35839-44-25-(Adamantan-1-yl)-3-((dimethylamino)methyl)-[1,1'-biphenyl]-2-ol5-(1-Adamantyl)-3-((dimethylamino)methyl)(1,1'-biphenyl)-2-olNSC1425985-(1-Adamantyl)-3-((dimethylamino)methyl)[1,1'-biphenyl]-2-olNSC 142598DTXSID10189370NSC-142598SB836764-(1-adamantyl)-2-(dimethylaminomethyl)-6-phenyl-phenol5-(Adamantan-1-yl)-3-[(dimethylamino)methyl][1,1'-biphenyl]-2-ol2-Phenyl-4-(1-adamantyl)-6-dimethylaminomethylphenol

Database identifiers

CAS
35839-44-2
PubChem CID
285587
DTXSID
DTXSID10189370

Properties

Computed structural propertiesFilling in

XLogP
6.4
Topological polar surface area
23.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
27
Formal charge
0
Complexity
481

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