1-Propene, 1-bromo-

Base Information

• Chemical Name: 1-Propene, 1-bromo-
• CAS No.: 590-15-8
• Molecular Formula: C3H5 Br
• Molecular Weight: 120.977
• European Community (EC) Number: 209-671-6,628-296-2
• DSSTox Substance ID: DTXSID0060438,DTXSID201311492
• Nikkaji Number: J2.681F,J2.682D
• Mol file: 590-15-8.mol

Synonyms:1-Bromo-1-propene;1-Propenyl bromide;1-Propene, 1-bromo-;1-Bromopropene;trans-1-Bromo-1-propene;590-15-8;1-Bromopropylene;Propenyl bromide;590-14-7;PROPENE, 1-BROMO-;trans-1-Bromopropene;1-Propene, 1-bromo-, (E)-;EINECS 209-671-6;(E)-1-Bromo-1-propene;BRN 1719096;1-propene, 1-bromo-, (1E)-;3-01-00-00710 (Beilstein Handbook Reference);cis-propenyl bromide;1-Bromo-1-propene (cis and trans);C3-H5-Br;(E)-1-bromoprop-1-ene;1-BROMO-PROPENE;trans-1-bromo-prop-1-ene;(1E)-1-bromoprop-1-ene;SCHEMBL246253;DTXSID0060438;DTXSID201311492;1-Bromo-1-propene(cis and trans);AMY19968;AKOS015913650;AS-81218;1-Bromo-1-propene (cis and trans), 98%;LS-123449;J-802022;trans-1-Bromo-1-propene contains copper as stabilizer;trans-1-Bromo-1-propene, contains copper as stabilizer, 99%

Chemical Property of 1-Propene, 1-bromo-

Chemical Property:

• Melting Point: −116 °C(lit.)
• Refractive Index: n20/D 1.454
• Boiling Point: 64-65 °C(lit.)
• Flash Point: °C
• PSA: 0.00000
• Density: 1.425g/cm³
• LogP: 1.91490
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 119.95746
• Heavy Atom Count: 4
• Complexity: 22.5

Purity/Quality:

98%,99%, ^*data from raw suppliers

trans-1-Bromo-1-propene contains copper as stabilizer, 99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,Xi
• Hazard Codes: F,Xi
• Statements: 11-36/37/38-53
• Safety Statements: 26-36-36/37/39-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Other Classes -> Halogenated Aliphatics, Unsaturated
• Canonical SMILES: CC=CBr
• Isomeric SMILES: C/C=C/Br
• Uses: trans -1-Bromo-1-propene is suitable for the synthesis of (E)-hex-4-en-2-yn-1-ol. trans -1-Bromo-1-propene ((E)-1-bromo-1-propene) may be used in the synthesis of the following:(E)-1,3-dimethyl-3-(prop-1-enyl)indolin-2-one3-alkenyl-Δ3-cephems(E)-1-(benzylthio)-1-propene

Technology Process of 1-Propene, 1-bromo-

There total 14 articles about 1-Propene, 1-bromo- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 90.0%

(Z)-but-2-enoic acid (503-64-0) → trans-2-propenyl bromide (590-15-8)

Guidance literature:

With diphosphorus tetraiodide; tetraethylammonium bromide; In carbon disulfide; at 20 ℃; for 12h;

DOI:10.1016/j.tetlet.2007.04.137

Reference yield: 86.0%

(E)-but-2-enoic acid (107-93-7) → trans-2-propenyl bromide (590-15-8)

Guidance literature:

With diphosphorus tetraiodide; tetraethylammonium bromide; In carbon disulfide; at 20 ℃; for 12h;

DOI:10.1016/j.tetlet.2007.04.137

Reference yield: 63.0%

1-bromo-1-propene (590-14-7) → trans-2-propenyl bromide (590-15-8)

Guidance literature:

With sodium hydroxide; In butan-1-ol; for 40h; Heating;

DOI:10.1016/S0040-4039(00)88045-4

upstream raw materials:

pyridine

erythro-2,3-dibromobutanoic acid

ethanol

1,2-Dibromopropane

Downstream raw materials:

1-phenylpropene

trans-propene-d1

(Z)-1-propenyl bromide

(E)-but-2-enoic acid

Refernces

• 1、 Telvekar, Vikas N.,Arote, Nitin D.,Herlekar, Omkar P.. "Mild and efficient method for decarboxylative bromination of α,β-unsaturated carboxylic acids with Dess-Martin periodinane". . p. 2495 - 2497. Retrieved 2007/10/03.
• 2、 Hayashi, Tamio,Kabeta, Keiji,Hamachi,Itaru,Kumada, Makoto. "ERYTHROSELECTIVITY IN ADDITION OF γ-SUBSTITUTED ALLYLSILANES TO ALDEHYDES IN THE PRESENCE OF TITANIUM CHLORIDE". . p. 2865 - 2868. Retrieved 2007/10/02.