1-Bromo-2-pentyne - ≥95% , CAS No.16400-32-1

CAS: 16400-32-1 Cat. No.: B136107 Formule: C₂H₅C≡CCH₂Br Poids moléculaire: 147.01 Numéro CE: 240-451-2

GRADE & PURITY ≥95%

Synonyms

EINECS 240-451-2 | VDHGRVFJBGRHMD-UHFFFAOYSA-N | STL557058 | EN300-331389 | E76728 | FT-0663820 | 2-Pentyne, 1-bromo- | SCHEMBL628602 | 2-Pentyn-1-yl bromide | MFCD00236363 | DTXSID90167691 | 2-Pentynyl Bromide | 1-bromo-pent-2-yne | 1-Bromopent-2-yne | S

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Vue d’ensemble

Product Describtion:

1-Bromo-2-pentyne is an halogenated hydrocarbon.

Specifications

Synonymes

EINECS 240-451-2 | VDHGRVFJBGRHMD-UHFFFAOYSA-N | STL557058 | EN300-331389 | E76728 | FT-0663820 | 2-Pentyne, 1-bromo- | SCHEMBL628602 | 2-Pentyn-1-yl bromide | MFCD00236363 | DTXSID90167691 | 2-Pentynyl Bromide | 1-bromo-pent-2-yne | 1-Bromopent-2-yne | S

Spécifications et pureté

≥95%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%

Noms et identifiants

Pubchem Sid

504755809

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755809

Sourires canoniques

CCC#CCBr

IUPAC Name

1-bromopent-2-yne

InChIKey

VDHGRVFJBGRHMD-UHFFFAOYSA-N

INCHI

1S/C5H7Br/c1-2-3-4-5-6/h2,5H2,1H3

Isomères SMILES

CCC#CCBr

WGK Allemagne

3

Poids moléculaire

147.01

Reaxy-Rn

1697767

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697767&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organobromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organobromides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organobromides
• Alternative Parents: Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organobromides. These are compounds containing a chemical bond between a carbon atom and a bromine atom.
• 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

Propriétés chimiques et physiques

• Solubilité: Miscible with ether
• Sensibilité: Moisture sensitive
• Indice de réfraction: 1.498
• Point d'éclair (°F): 105.8 °F
• Point d'éclair (°C): 41 °C
• Point d'ébullition (°C): 93-94 °C/113 mmHg
• Poids moléculaire: 147.010 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 145.973 Da
• Monoisotopic Mass: 145.973 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 72.400
• 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: 1