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N,N,4-Trimethyl-3-(naphthalen-1-yl)hexan-1-amine

HCID 33227
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Basic information

CAS
25913-45-5
Standard SMILES
CCC(C)C(CCN(C)C)c1cccc2ccccc12
InChIKey
VSVVRVMZGNOYIC-UHFFFAOYSA-N
Molecular formula
C19H27N
Average molar mass
269.4 g/mol
Monoisotopic mass
269.21434987

Names & identifiers

Preferred name
N,N,4-Trimethyl-3-(naphthalen-1-yl)hexan-1-amine
IUPAC
N,N,4-trimethyl-3-naphthalen-1-ylhexan-1-amine
English name
N,N-Dimethyl-γ-(1-methylpropyl)-1-naphthalene-1-propanamine
Molecular formula
C19H27N
Molecular weight
269.43

Names & synonyms

25913-45-5DTXSID10948823N,N,4-Trimethyl-3-(naphthalen-1-yl)hexan-1-amineRefChem:1090307DTXCID3013770371-NAPHTHALENEPROPYLAMINE, N,N-DIMETHYL-gamma-(sec-BUTYL)-delta,N,N-Trimethyl-3-(1-naphthyl)hexylamineHexylamine, delta,N,N-trimethyl-3-(1-naphthyl)-N,N-Dimethyl-gamma-(sec-butyl)-1-naphthalenepropylamine1-Naphthalenepropylamine, gamma-(sec-butyl)-N,N-dimethyl-N,N,4-trimethyl-3-naphthalen-1-ylhexan-1-amine1-Naphthalenepropanamine, N,N-dimethyl-γ-(1-methylpropyl)-
Show more names
N,N-Dimethyl-γ-(1-methylpropyl)-1-naphthalene-1-propanamine

Database identifiers

CAS
25913-45-5
PubChem CID
33227
DTXSID
DTXSID10948823
Nikkaji
J42.431E

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
6
Heavy atoms
20
Formal charge
0
Complexity
273

Physicochemical properties

Boiling point
374.7 · 374.7±21.0 °C(Predicted)
Density
0.961 · 0.961±0.06 g/cm3(Predicted)
pka
9.57 · 9.57±0.28(Predicted)

Related reactions

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Compound notes

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