sec-Butyl bromide - CP , CAS No.78-76-2

CAS: 78-76-2 Cat. No.: B109117 Formule: C₄H₉Br Poids moléculaire: 137.02 Beilstein Registry Number: 505949 Numéro CE: 201-140-7

GRADE & PURITY CP

Synonyms

NSC 8417 | 2-Bromo butane | EINECS 201-140-7 | 2-Bromobutane | DTXCID201499 | J-802068 | SEC-BUTYL BROMIDE, (+/-)- | 2-Bromobutane, purum, >=98.0% (GC) | Methylethylbromomethane | NCGC00258187-01 | Butane, 2-bromo- | AKOS009157105 | 2-Bromobutane sec-Buty

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Synonymes

NSC 8417 | 2-Bromo butane | EINECS 201-140-7 | 2-Bromobutane | DTXCID201499 | J-802068 | SEC-BUTYL BROMIDE, (+/-)- | 2-Bromobutane, purum, >=98.0% (GC) | Methylethylbromomethane | NCGC00258187-01 | Butane, 2-bromo- | AKOS009157105 | 2-Bromobutane sec-Buty

Spécifications et pureté

CP

Conditions de stockage de stockage

Room temperature

Expédié en

FedEx DG Service

Grade

CP

Noms et identifiants

Pubchem Sid

488180093

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180093

Sourires canoniques

CCC(C)Br

IUPAC Name

2-bromobutane

InChIKey

UPSXAPQYNGXVBF-UHFFFAOYSA-N

INCHI

1S/C4H9Br/c1-3-4(2)5/h4H,3H2,1-2H3

Isomères SMILES

CCC(C)Br

WGK Allemagne

2

RTECS

EJ6228000

Numéro ONU

2339

Groupe d'emballage

II

Poids moléculaire

137.02

Beilstein

505949

Reaxy-Rn

505949

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=505949&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

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Insoluble in water; Soluble in Methanol,Chloroform,Acetone,Ether
• Sensibilité: Light Sensitive
• Indice de réfraction: 1.4366
• Point d'éclair (°F): 21℃
• Point d'éclair (°C): 21℃
• Point d'ébullition (°C): 91.2°C
• Point de fusion (°C): -111.9°C
• Poids moléculaire: 137.020 g/mol
• XLogP3: 2.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 135.989 Da
• Monoisotopic Mass: 135.989 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 19.600
• 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

Foire aux questions

What does CP mean?

CP is a defined analytical purity tier suitable for general analytical and reagent applications. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. CP is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 78-76-2, the molecular formula is C4H9Br, and the molecular weight is 137.02 g/mol. InChIKey UPSXAPQYNGXVBF-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.