1-[3-(Bromomethyl)phenyl]-1H-pyrrole

Base Information

Chemical Name:1-[3-(Bromomethyl)phenyl]-1H-pyrrole
CAS No.:112596-36-8
Molecular Formula:C11H10 Br N
Molecular Weight:236.111
Hs Code.:2933990090
DSSTox Substance ID:DTXSID30380160
Wikidata:Q82170257
Mol file:112596-36-8.mol

Synonyms:1-[3-(Bromomethyl)phenyl]-1H-pyrrole;112596-36-8;1-[3-(bromomethyl)phenyl]pyrrole;1-(3-(bromomethyl)phenyl)-1h-pyrrole;1-3-Bromomethylphenyl-1H-pyrrole;1H-Pyrrole,1-[3-(bromomethyl)phenyl]-;3-Pyrrol-1-ylbenzyl bromide;SCHEMBL201853;DTXSID30380160;YMWNCAQFJODGRZ-UHFFFAOYSA-N;MFCD03086141;1-(3-bromomethyl-phenyl)-1H-pyrrole;AKOS015912075;SB62320;FT-0607109;A802610;1-[3-(Bromomethyl)phenyl]-1H-pyrrole, AldrichCPR;TRANS,TRANS-4-PROPENYL-4-PROPYL-BICYCLOHEXYL;W-204790

Suppliers and Price of 1-[3-(Bromomethyl)phenyl]-1H-pyrrole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
1g
$ 1320.00

TRC
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
100mg
$ 165.00

SynQuest Laboratories
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
250 mg
$ 104.00

SynQuest Laboratories
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
1 g
$ 237.00

Biosynth Carbosynth
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
1 g
$ 1638.00

Biosynth Carbosynth
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
250 mg
$ 497.50

Biosynth Carbosynth
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
500 mg
$ 905.00

Biosynth Carbosynth
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
100 mg
$ 273.00

Biosynth Carbosynth
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
50 mg
$ 150.50

Apolloscientific
1-[3-(Bromomethyl)phenyl]-1H-pyrrole
250mg
$ 88.00

Total 12 raw suppliers

Chemical Property of 1-[3-(Bromomethyl)phenyl]-1H-pyrrole

Chemical Property:

Vapor Pressure:0.000432mmHg at 25°C
Melting Point:54 °C
Boiling Point:325.6°Cat760mmHg
PKA:-5.49±0.70(Predicted)
Flash Point:150.7°C
PSA：4.93000
Density:1.34g/cm³
LogP:3.37220
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:2
Exact Mass:234.99966
Heavy Atom Count:13
Complexity:154

Purity/Quality:

97% ^*data from raw suppliers

1-[3-(Bromomethyl)phenyl]-1H-pyrrole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:C
Statements: R34:Causes burns.;
Safety Statements: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39:Wear suitabl

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CN(C=C1)C2=CC=CC(=C2)CBr
Uses 1-[3-(Bromomethyl)phenyl]-1H-pyrrole is an intermediate in the preparation of Iminoribitol derivatives as inhibitors of a purine specific nucleoside hydrolase

Technology Process of 1-[3-(Bromomethyl)phenyl]-1H-pyrrole

There total 4 articles about 1-[3-(Bromomethyl)phenyl]-1H-pyrrole 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: 95.0%

: 83140-94-7
(3-(1H-pyrrol-1-yl)phenyl)methanol

: 112596-36-8
1-[3-(bromomethyl)phenyl]-1H-pyrrole

Guidance literature:: With phosphorus tribromide; In diethyl ether; for 4h; Heating;
DOI:10.1021/jm00399a021

Reference yield:

: 4518-10-9
Methyl 3-aminobenzoate

: 112596-36-8
1-[3-(bromomethyl)phenyl]-1H-pyrrole

Guidance literature:: Multi-step reaction with 3 steps

1: 65 percent / glacial acetic acid / 0.5 h / Heating

2: 73 percent / lithium aluminum hydride / diethyl ether / 3 h / Heating

3: 95 percent / phosphorus tribromide / diethyl ether / 4 h / Heating

With lithium aluminium tetrahydride; phosphorus tribromide; acetic acid; In diethyl ether;
DOI:10.1021/jm00399a021

Reference yield:

: 83140-93-6,168618-25-5
methyl 3-(1H-pyrrol-1-yl)benzoate

: 112596-36-8
1-[3-(bromomethyl)phenyl]-1H-pyrrole

Guidance literature:: Multi-step reaction with 2 steps

1: 73 percent / lithium aluminum hydride / diethyl ether / 3 h / Heating

2: 95 percent / phosphorus tribromide / diethyl ether / 4 h / Heating

With lithium aluminium tetrahydride; phosphorus tribromide; In diethyl ether;
DOI:10.1021/jm00399a021