6-Bromoisochroman

Base Information

Chemical Name:6-Bromoisochroman
CAS No.:182949-90-2
Molecular Formula:C9H9BrO
Molecular Weight:213.07100
Hs Code.:2932999099
DSSTox Substance ID:DTXSID40444727
Nikkaji Number:J779.148H
Wikidata:Q72454553
Mol file:182949-90-2.mol

Synonyms:6-bromoisochroman;182949-90-2;6-Bromo-isochroman;6-BROMO-3,4-DIHYDRO-1H-2-BENZOPYRAN;6-BROMOISOCHROMANE;6-BROMO-3,4-DIHYDRO-1H-ISOCHROMENE;1H-2-Benzopyran, 6-bromo-3,4-dihydro-;MFCD11226898;6-Bromo-isochromane;SCHEMBL5366924;DTXSID40444727;BCP08491;AKOS015834751;MB09745;AC-25655;AM803403;AS-39623;SY101936;CS-0037712;FT-0740699;A26297;EN300-196949;J-518437

Suppliers and Price of 6-Bromoisochroman

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
6-Bromoisochroman
250mg
$ 640.00

Crysdot
6-Bromo-isochroman 95+%
1g
$ 436.00

Crysdot
6-Bromo-isochroman 95+%
250mg
$ 174.00

ChemScene
6-Bromoisochromane
1g
$ 501.00

ChemScene
6-Bromoisochromane
5g
$ 1504.00

Chemenu
6-Bromo-3,4-dihydro-1H-2-benzopyran 95%
10g
$ 1575.00

American Custom Chemicals Corporation
6-BROMOISOCHROMAN 95.00%
5MG
$ 500.50

Alichem
6-Bromoisochroman
25g
$ 3927.89

Alichem
6-Bromoisochroman
10g
$ 2222.00

Alichem
6-Bromoisochroman
5g
$ 1817.03

Total 30 raw suppliers

Chemical Property of 6-Bromoisochroman

Chemical Property:

Vapor Pressure:0.007mmHg at 25°C
Boiling Point:279.369oC at 760 mmHg
Flash Point:110.571oC
PSA：9.23000
Density:1.485g/cm3
LogP:2.52180
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:211.98368
Heavy Atom Count:11
Complexity:138

Purity/Quality:

97% ^*data from raw suppliers

6-Bromoisochroman ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1COCC2=C1C=C(C=C2)Br
Uses 6-Bromoisochroman is a useful reagent in the study of manganese dioxide-methanesulfonic acid promoted dehydrogenative alkylation of sp3 C-H bonds adjacent to heteroatom.

Technology Process of 6-Bromoisochroman

There total 8 articles about 6-Bromoisochroman 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: 77.0%

: 444588-39-0
6-amino-3,4-dihydro-1H-2-benzopyran

: 182949-90-2
6-bromo-3,4-dihydro-1H-isochromene

Guidance literature:: 6-amino-3,4-dihydro-1H-2-benzopyran; With hydrogen bromide; sodium nitrite; In water; at 0 ℃; for 0.333333h;

With hydrogen bromide; copper(I) bromide; In water; at 0 ℃; for 0.666667h;

Reference yield: 17.0%

: 846037-84-1
1-bromo-3-(2-((2-methoxyethoxy)methoxy)ethyl)benzene

: 182949-90-2
6-bromo-3,4-dihydro-1H-isochromene

: 846037-83-0
8-bromo-3,4-dihydro-1H-isochromene

Guidance literature:: With titanium tetrachloride; In dichloromethane; at 0 ℃; for 0.75h;
DOI:10.1016/j.tetlet.2007.02.121

Reference yield: 15.0%

: 3970-21-6
2-Methoxyethoxymethyl chloride

: 28229-69-8
2-(3-bromophenyl)ethan-1-ol

: 182949-90-2
6-bromo-3,4-dihydro-1H-isochromene

Guidance literature:: 2-Methoxyethoxymethyl chloride; 2-(3-bromophenyl)ethan-1-ol; With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 2.5h; Inert atmosphere;

With trimethylsilyl trifluoromethanesulfonate; In acetonitrile; at 0 - 20 ℃;
DOI:10.1021/jo4000674