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4-Heptylamine, N,N-dipropyl-, hydrochloride

HCID 44806
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Basic information

CAS
63834-42-4
Standard SMILES
CCCC(CCC)[NH+](CCC)CCC.[Cl-]
InChIKey
XGJBEXXFJLMBJT-UHFFFAOYSA-N
Molecular formula
C13H30ClN
Average molar mass
235.84 g/mol
Monoisotopic mass
235.2066777

Names & identifiers

Preferred name
4-Heptylamine, N,N-dipropyl-, hydrochloride
IUPAC
heptan-4-yl(dipropyl)azanium chloride

Names & synonyms

4-HEPTYLAMINE, N,N-DIPROPYL-, HYDROCHLORIDE63834-42-4RefChem:1070706N,N-Dipropyl-4-heptylamine hydrochloride

Database identifiers

CAS
63834-42-4
PubChem CID
44806

Properties

Computed structural properties

Topological polar surface area
4.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
9
Heavy atoms
15
Formal charge
0
Complexity
99.8

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