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1-Naphthamidine, 1-butoxy-N,N-dioctyl-, monohydrochloride

HCID 35530
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Basic information

CAS
30832-55-4
Standard SMILES
CCCCCCCC[NH+](CCCCCCCC)C(=N)c1ccc(OCCCC)c2ccccc12.[Cl-]
InChIKey
GSMFFPAGZVRAPY-UHFFFAOYSA-N
Molecular formula
C31H51ClN2O
Average molar mass
503.2 g/mol
Monoisotopic mass
502.3689919

Names & identifiers

Preferred name
1-Naphthamidine, 1-butoxy-N,N-dioctyl-, monohydrochloride
IUPAC
(4-butoxynaphthalene-1-carboximidoyl)-dioctylazanium chloride

Names & synonyms

1-NAPHTHAMIDINE, 1-BUTOXY-N,N-DIOCTYL-, MONOHYDROCHLORIDE30832-55-4RefChem:10560044-Butoxy-N,N-dioctyl-1-naphthamidine, hydrochloride

Database identifiers

CAS
30832-55-4
PubChem CID
35530

Properties

Computed structural properties

Topological polar surface area
37.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
20
Heavy atoms
35
Formal charge
0
Complexity
492

Related reactions

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Compound notes

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