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Home > Encyclopedia > 1,5-Dimethylhexylamine

1,5-Dimethylhexylamine

1,5-Dimethylhexylamine structure

1,5-Dimethylhexylamine 

structure
  • CAS No:

    543-82-8

  • Formula:

    C8H19N

  • Chemical Name:

    1,5-Dimethylhexylamine

  • Synonyms:

    1,5-dimethyl-hexylamin;2-Heptanamine, 6-methyl-;2-Heptylamine, 6-methyl-;2-Isooctylamine;2-Methyl-6-aminoheptane;2-Metil-6-amino-eptano;6-Amino-2-methylheptane;6-methyl-2-heptanamin

  • Categories:

    Organic Chemistry  >  Amides

Description

(±)-1,5-Dimethylhexylamine is an aliphatic amine with the molecular formula C₈H₁₉N and a molecular weight of 129.24 g/mol. It typically appears as a clear, colorless to light yellow liquid with a characteristic fishy odor. The compound has a boiling point of approximately 154–156 °C and a density of 0.767 g/mL at 25 °C. It is slightly soluble in water but more readily dissolves in organic solvents such as methanol, ethanol, and chloroform.


(±)-1,5-Dimethylhexylamine is an aliphatic amine with the molecular formula C₈H₁₉N and a molecular weight of 129.24 g/mol. It typically appears as a clear, colorless to light yellow liquid with a characteristic fishy odor. The compound has a boiling point of approximately 154–156 °C and a density of 0.767 g/mL at 25 °C. It is slightly soluble in water but more readily dissolves in organic solvents such as methanol, ethanol, and chloroform.


clear colorless to light yellow liquid with fishy smell.


ChEBI: Octodrine is an alkylamine.

1,5-Dimethylhexylamine Basic Attributes

129.24

129.24

1209250

208-851-1

759813

TSCA listed

DTXSID8046535

White to Off-White

2921199090

Characteristics

26.02000

2.86020

clear colorless to light yellow liquid

0.767 g/mL at 25 °C(lit.)

25°C

154-156 °C(lit.)

48ºC

n20/D1.422(lit.)

Flammables area

pKa 10.28 ± 0.1(H2O,t =25±0.2,I<0.001) (Uncertain)

134.7 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

Flammables area

Safety Information

III

3

UN 1993

3

Xn

26-36/37/39-37/39-16

MQ4840000

Xn

P261-P305 + P351 + P338

10-22-36/37/38

UN 1993 3/PG 3

|Danger|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

2-amino-6-methylheptane

1,5-Dimethylhexylamine Use and Manufacturing

Uses

(±)-1,5-Dimethylhexylamine has been used as a pharmaceutical intermediate, particularly in the synthesis of compounds like octamylamine, which possess antispasmodic properties. It has also been explored for its potential as a local anesthetic and vasoconstrictor. Additionally, due to its sympathomimetic effects, it has been included in some dietary supplements aimed at enhancing energy and focus.


(±)-1,5-Dimethylhexylamine has been used as a pharmaceutical intermediate, particularly in the synthesis of compounds like octamylamine, which possess antispasmodic properties. It has also been explored for its potential as a local anesthetic and vasoconstrictor. Additionally, due to its sympathomimetic effects, it has been included in some dietary supplements aimed at enhancing energy and focus.


1,5-Dimethylhexylamine is an aliphatic secondary amine which shows leucine aminotransferase inhibition. 1,5-Dimethylhexylamine is used in the preparation of glycosyl β-amino acids with antitubercular activity.


2-Amino-6-methylheptane can be used as:A building block for the synthesis ofn-type photoconductor,N,N′-bis(1,5-dimethylhexyl)-3,4:9,10-perylenebis (dicarbox-imide) (PDHEP).A reagent in the synthesis of substituted pyrrolidones by reductive amination of levulinic acid using supported platinum catalyst.A nucleophilic amine in the synthesis of unsymmetrical sulfamide by reacting with sulfamic acid salts and triphenylphosphine ditriflate.

2-Heptanamine, 6-methyl-: ACTIVE

Computed Properties

Molecular Weight:129.24
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:129.151749610
Monoisotopic Mass:129.151749610
Topological Polar Surface Area:26
Heavy Atom Count:9
Complexity:59.6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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