1,3-Dibromopropane - ≥98% , CAS No.109-64-8

CAS: 109-64-8 Cat. No.: D104777 분자식: C₃H₆Br₂ 분자량: 201.89 Beilstein Registry Number: 635662 EC 번호: 203-690-3

등급 & 순도 ≥98%

Synonyms

1,3-dibromopropan | InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H | UNII-YQR3048IX9 | .alpha.,.gamma.-Dibromopropane | AMY25527 | F0001-0197 | Q408240 | A802067 | BBL011375 | 1.3-dibromopropane | Br(CH2)3Br | BP-31190 | Dibromo-1,3 propane | CH2BrCH2CH2Br | 1,3-Dibrom

Storage

Protected from light,Room temperature,Argon charged

Shipped In

FedEx DG Service

개요

Product Description
1,3-Dibromopropane is a dihalogenated propane. It undergoes reduction catalyzed by electrogenerated solution-phase nickel(I) salen and nickel(I) salen confined in a polymer film on the surface of a carbon electrode to afford cyclopropane and propylene, respectively.
Product Application
1,3-Dibromopropane is used to prepare C3-bridged compounds through C-N coupling reactions. It is used in the preparation of 2,3,4,5-tetrahydro-7,7-diphenylimidazo- [2,1-b]-thiazine-6(7H)-one by reacting with potassium salt of 5,5-diphenyl-2-thiohydantoin.

사양

동의어

1,3-dibromopropan | InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H | UNII-YQR3048IX9 | .alpha.,.gamma.-Dibromopropane | AMY25527 | F0001-0197 | Q408240 | A802067 | BBL011375 | 1.3-dibromopropane | Br(CH2)3Br | BP-31190 | Dibromo-1,3 propane | CH2BrCH2CH2Br | 1,3-Dibrom

사양 및 순도

≥98%

보관 조건

Protected from light,Room temperature,Argon charged

배송

FedEx DG Service

순수함

≥98%

이름과 식별자

Pubchem Sid

508807031

정식 스마일

C(CBr)CBr

IUPAC Name

1,3-dibromopropane

InChIKey

VEFLKXRACNJHOV-UHFFFAOYSA-N

INCHI

1S/C3H6Br2/c4-2-1-3-5/h1-3H2

이성체 SMILES

C(CBr)CBr

WGK 독일

2

RTECS

TX8575000

UN 번호

1993

분자량

201.89

Beilstein

635662

Reaxy-Rn

635662

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635662&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • 분류 Organobromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• 분류: 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
• 설명: 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

화학 및 물리적 특성

• 용해성: Soluble in ether, alcohol, water
• 감도: Light sensitive.
• 굴절률: 1.5232
• 발화점(°F): 130°F
• 발화점(°C): 54℃
• 끓는점(°C): 165°C
• 녹는점(°C): −34 °C (lit.)
• 분자량: 201.890 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 201.882 Da
• Monoisotopic Mass: 199.884 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• 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: 1