4-Heptylamine - ≥98%(GC)(T) , CAS No.16751-59-0

CAS: 16751-59-0 Cat. No.: H156930 Formula: C₇H₁₇N Peso molecolare: 115.22 Numero EC: 240-814-5

GRADE & PURITY ≥98%(GC)(T)

Synonyms

(1-propylbutyl)amine | STK520612 | 1-Propylbutylamine, AldrichCPR | BBL003306 | EINECS 240-814-5 | 4-Heptanamine | Butylamine, 1-propyl- | SY024496 | 1-Propylbutanamine | AMY3864 | SCHEMBL284709 | J-010376 | 4-04-00-00745 (Beilstein Handbook Reference) |

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

(1-propylbutyl)amine | STK520612 | 1-Propylbutylamine, AldrichCPR | BBL003306 | EINECS 240-814-5 | 4-Heptanamine | Butylamine, 1-propyl- | SY024496 | 1-Propylbutanamine | AMY3864 | SCHEMBL284709 | J-010376 | 4-04-00-00745 (Beilstein Handbook Reference) |

Specifiche e purezza

≥98%(GC)(T)

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥98%(GC)(T)

Nomi e identificatori

• Pubchem Sid: 504753574
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753574
• Sorrisi canonici: CCCC(CCC)N
• IUPAC Name: heptan-4-amine
• InChIKey: CLJMMQGDJNYDER-UHFFFAOYSA-N
• INCHI: 1S/C7H17N/c1-3-5-7(8)6-4-2/h7H,3-6,8H2,1-2H3
• Isomeri SMILES: CCCC(CCC)N
• RTECS: EO6025000
• Peso molecolare: 115.22
• Reaxy-Rn: 1697157
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697157&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: 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
• Descrizione: 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

Proprietà chimiche e fisiche

• Sensibilità: air sensitive
• Indice di rifrazione: 1.42
• Punto di infiammabilità (°C): 41 °C
• Punto di ebollizione (°C): 140°C
• Peso molecolare: 115.220 g/mol
• XLogP3: 1.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 115.136 Da
• Monoisotopic Mass: 115.136 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 37.700
• 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: 1