1,3-Dimethylpentylamine Hydrochloride - ≥98% , CAS No.13803-74-2

CAS: 13803-74-2 Cat. No.: D135535 Molecular Weight: 151.68 EC Number: 687-991-9

GRADE & PURITY ≥98%

Synonyms

BCP07039 | Methylhexanamine.HCl | 4-methyl-2-hexanamine hcl | methylhexanamine (hydrochloride) | Dimethylamylamine Hydrochloride; 4-Methyl-2-hexanamine Hydrochloride; DMAA HCl | 4-Methyl-2-hexylamine Hydrochloride | AKOS015894246 | carvone, (+--)- | 2-Hex

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

product description：

Methylhexanamine is a naturally substance isolated from Pelargonium graveolen. It is a component of geranium oil. Methylhexanamine is a sympathomimentic that increase levels of norepinephrine in the synaptic cleft.Methylhexanamine induces fat degradation and prevents energy loss during exercise. Thus, it serves as an active ingredient of many dietary supplements.

Specifications

Synonyms

BCP07039 | Methylhexanamine.HCl | 4-methyl-2-hexanamine hcl | methylhexanamine (hydrochloride) | Dimethylamylamine Hydrochloride; 4-Methyl-2-hexanamine Hydrochloride; DMAA HCl | 4-Methyl-2-hexylamine Hydrochloride | AKOS015894246 | carvone, (+--)- | 2-Hex

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Action Type

AGONIST

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488200939
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488200939
• Canonical Smiles: CCC(C)CC(C)N.Cl
• IUPAC Name: 4-methylhexan-2-amine;hydrochloride
• InChIKey: ZKKBPHUAHARETG-UHFFFAOYSA-N
• INCHI: 1S/C7H17N.ClH/c1-4-6(2)5-7(3)8;/h6-7H,4-5,8H2,1-3H3;1H
• Isomeric SMILES: CCC(C)CC(C)N.Cl
• WGK Germany: 3
• Molecular Weight: 151.68
• Reaxy-Rn: 6314491
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6314491&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Hydrochloride - Primary aliphatic amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic amine group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Solubility: H2O: 5 mg/mL (clear solution)
• Sensitivity: Moisture sensitive.
• Melt Point(°C): 128.0-132.0 °C
• Molecular Weight: 151.680 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 151.113 Da
• Monoisotopic Mass: 151.113 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 52.300
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

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