1，6-Diaminohexane Dihydrochloride - ≥98% , CAS No.6055-52-3

CAS: 6055-52-3 Cat. No.: D134228 Molecular Weight: 189.12 EC Number: 227-977-8 PubChem CID: 2786615

GRADE & PURITY ≥98%

Synonyms

1,6-Diaminohexane dihydrochloride | Hexamethylenediammonium dichloride | 1,6-Hexamethylenediamine-1,6-dihydrochloride | EINECS 227-977-8 | UNII-6IF950ZP7C | H11757 | FT-0660895 | 1,6-Hexanediamine, hydrochloride (1:2) | 1,6-Hexamethylenediamine dihydrochl

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

product description：
Toxicity of hexamethylenediamine dihydrochloride has been investigated. Hexamethylenediamine dihydrochloride is also known as 1,6-diaminohexane dihydrochloride, 1,6-hexamethylenediamine dihydrochloride, 1,6- hexylenediamine dihydrochloride or 1,6-diamino-n-hexane dihydrochloride. Hexamethylenediamine dihydrochloride on fusion of 1:6-di-(N3-cyano-N1-guanidino)-hexane yields polymeric diguanides.

Specifications

Synonyms

1, 6-Diaminohexane dihydrochloride | Hexamethylenediammonium dichloride | 1, 6-Hexamethylenediamine-1, 6-dihydrochloride | EINECS 227-977-8 | UNII-6IF950ZP7C | H11757 | FT-0660895 | 1, 6-Hexanediamine, hydrochloride (1:2) | 1, 6-Hexamethylenediamine dihydrochl

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488193969
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488193969
• Canonical Smiles: C(CCCN)CCN.Cl.Cl
• IUPAC Name: hexane-1,6-diamine;dihydrochloride
• InChIKey: XMVQMBLTFKAIOX-UHFFFAOYSA-N
• INCHI: 1S/C6H16N2.2ClH/c7-5-3-1-2-4-6-8;;/h1-8H2;2*1H
• Isomeric SMILES: C(CCCN)CCN.Cl.Cl
• WGK Germany: 3
• RTECS: MO1312000
• PubChem CID: 2786615
• Molecular Weight: 189.12
• Reaxy-Rn: 3907528

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: Organopnictogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - 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: Solubility in water: Completely soluble
• Sensitivity: Moisture sensitive
• Melt Point(°C): 248 °C
• Molecular Weight: 189.120 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 188.085 Da
• Monoisotopic Mass: 188.085 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 31.500
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 3

XLogP3

References

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