Propyldiammonium Dichloride - ≥99.5%(4 Times Purification) , CAS No.10517-44-9

CAS: 10517-44-9 Cat. No.: P494086 Molecular Weight: 147.04 Beilstein Registry Number: 4261 EC Number: 234-051-7 PubChem CID: 165887

GRADE & PURITY ≥99.5%(4 Times Purification)

Synonyms

1,3-Diaminopropane hydrochloride | DTXSID4074437 | 1,3-Propanediamine, dihydrochloride | EINECS 234-051-7 | FT-0636723 | 1,3-PROPANEDIAMINE-2,2-D2 2HCL | 1,3-DIAMINOPROPANE 2HCL (LOW WATER CONTENT) | T70045 | YSZC2888 | 1,3-Diaminopropane dihydrochloride

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

1, 3-Diaminopropane hydrochloride | DTXSID4074437 | 1, 3-Propanediamine, dihydrochloride | EINECS 234-051-7 | FT-0636723 | 1, 3-PROPANEDIAMINE-2, 2-D2 2HCL | 1, 3-DIAMINOPROPANE 2HCL (LOW WATER CONTENT) | T70045 | YSZC2888 | 1, 3-Diaminopropane dihydrochloride

Specifications & Purity

≥99.5%(4 Times Purification)

Storage

Protected from light, Room temperature, Argon charged

Shipped In

Normal

Purity

≥99.5%(4 Times Purification)

Names and Identifiers

• Pubchem Sid: 504757585
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757585
• Canonical Smiles: C(CN)CN.Cl.Cl
• IUPAC Name: propane-1,3-diamine;dihydrochloride
• InChIKey: HYOCSVGEQMCOGE-UHFFFAOYSA-N
• INCHI: 1S/C3H10N2.2ClH/c4-2-1-3-5;;/h1-5H2;2*1H
• Isomeric SMILES: C(CN)CN.Cl.Cl
• RTECS: TX7392500
• PubChem CID: 165887
• UN Number: 2811
• Packing Group: III
• Molecular Weight: 147.04
• Beilstein: 4261
• Reaxy-Rn: 3906419

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 Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - 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: Soluble in mostly organic solvent
• Sensitivity: Moisture sensitive；air sensitive；light sensitive
• Melt Point(°C): 246-250°C
• Molecular Weight: 147.040 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 146.038 Da
• Monoisotopic Mass: 146.038 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 12.400
• 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

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