2-Methyl-1,5-diaminopentane - ≥98%(GC)(T) , CAS No.15520-10-2

CAS: 15520-10-2 Cat. No.: M158599 Molecular Weight: 116.21 EC Number: 239-556-6

GRADE & PURITY ≥98%(GC)(T)

Synonyms

3-(Benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid | MFCD00013460 | UNII-0FYC3Y758A | 3-04-00-00609 (Beilstein Handbook Reference) | Q27236722 | 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-ethyl-beta-D-ribofuranuronamide | 1,5-Diamino-2-methylpen

Storage

Room temperature

Shipped In

Normal

Overview

Amine Monomers, Monomers, Polymer Science, Primary Amines

Specifications

Synonyms

3-(Benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid | MFCD00013460 | UNII-0FYC3Y758A | 3-04-00-00609 (Beilstein Handbook Reference) | Q27236722 | 1-(6-Amino-9H-purin-9-yl)-1-deoxy-N-ethyl-beta-D-ribofuranuronamide | 1, 5-Diamino-2-methylpen

Specifications & Purity

≥98%(GC)(T)

Storage

Room temperature

Shipped In

Normal

Purity

≥98%(GC)(T)

Names and Identifiers

• Pubchem Sid: 488186348
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186348
• Canonical Smiles: CC(CCCN)CN
• IUPAC Name: 2-methylpentane-1,5-diamine
• InChIKey: JZUHIOJYCPIVLQ-UHFFFAOYSA-N
• INCHI: 1S/C6H16N2/c1-6(5-8)3-2-4-7/h6H,2-5,7-8H2,1H3
• Isomeric SMILES: CC(CCCN)CN
• RTECS: SA0248500
• Molecular Weight: 116.21
• Reaxy-Rn: 1732701
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1732701&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: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - 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 miscible
• Refractive Index: 1.4580 - 1.4620
• Flash Point(°F): 85°C(lit.)
• Flash Point(°C): 85°C(lit.)
• Boil Point(°C): 78°C/11mmHg(lit.)
• Molecular Weight: 116.200 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 116.131 Da
• Monoisotopic Mass: 116.131 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 45.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

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2. Lemeng Wang, Chi Fang, Xiaoqian Du, Kun Fu, Xiangfeng Tian, Pan Zhang, Dong Fu.  (2020)  Surface thermodynamics and viscosity of 1-dimethylamino-2-propanol + 1-(2-aminoethyl)piperazine and 1-dimethylamino-2-propanol + 1,5-diamino-2-methylpentane aqueous solutions.  JOURNAL OF CHEMICAL THERMODYNAMICS,      [PMID:] [10.1016/j.jct.2020.106242]

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