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N-((5-Nitro-2-furanyl)methylene)tricyclo(3.3.1.1(sup 3,7))decan-1-amine

HCID 64391
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Basic information

CAS
57277-87-9
Standard SMILES
O=[N+]([O-])c1ccc(C=NC23CC4CC(CC(C4)C2)C3)o1
InChIKey
RWLAVVXKGZDKMF-UHFFFAOYSA-N
Molecular formula
C15H18N2O3
Average molar mass
274.31 g/mol
Monoisotopic mass
274.13174244

Names & identifiers

Preferred name
N-((5-Nitro-2-furanyl)methylene)tricyclo(3.3.1.1(sup 3,7))decan-1-amine
IUPAC
N-(1-adamantyl)-1-(5-nitrofuran-2-yl)methanimine

Names & synonyms

N-((5-Nitro-2-furanyl)methylene)tricyclo(3.3.1.1(sup 3,7))decan-1-amine57277-87-91-((5-Nitrofurfurylidene)amino)adamantaneTricyclo(3.3.1.1(sup 3,7))decan-1-amine, N-((5-nitro-2-furanyl)methylene)-

Database identifiers

CAS
57277-87-9
PubChem CID
64391
Nikkaji
J675.119I

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
71.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Formal charge
0
Complexity
402

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Compound notes

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