4-Bromodibenzothiophene

HCID 458352
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Basic information

CAS
97511-05-2
Standard SMILES
Brc1cccc2c1sc1ccccc12
InChIKey
GJXAVNQWIVUQOD-UHFFFAOYSA-N
Molecular formula
C12H7BrS
Average molar mass
263.15 g/mol
Monoisotopic mass
261.94518332

Names & identifiers

Preferred name
4-Bromodibenzothiophene
IUPAC
4-bromodibenzothiophene
English name
4-BROMODIBENZOTHIOPHENE
Molecular formula
C12H7BrS
Molecular weight
263.15

Names & synonyms

4-Bromodibenzothiophene97511-05-2DTXSID50332505RefChem:520498DTXCID00283598828-272-34-bromodibenzo[b,d]thiopheneMFCD02683746Dibenzothiophene, 4-bromo-4-Bromodibenzo[b,d]thiophene;Dibenzothiophene, 4-bromo-SCHEMBL232632dibenzo[b,d]thiophene, 4-bromo-
Show more names
DBT-Bra4-DCDT-ADibenzothiophene,4-broMo-4-Bromodibenzothiophene>4-Bromodibenzo[b]thiophenebest offer 4-BROMODIBENZOTHIOPHENE4-Bromodibenzothiophene in isooctane4-BROMODIBENZOTHIOPHENE ISO 9001：2015 REACH
GJXAVNQWIVUQOD-UHFFFAOYSA-NGEO-02665AKOS016008829CS-W022120DS-4628SY030030DB-028760B4449

Database identifiers

CAS
97511-05-2
PubChem CID
458352
DTXSID
DTXSID50332505
EC Number
828-272-3
Nikkaji
J393.993F

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
28.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
14

Physicochemical properties

Melting point
85 to · 85.0 to 89.0 °C
Boiling point
386.6 · 386.6±15.0 °C(Predicted)
Density
1.611 · 1.611
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
Appearance
White to off-white Solid
InChI
InChI=1S/C12H7BrS/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-7H

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

hs_code
2934208090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Uses4-Bromodibenzothiophene is used as an intermediate in pharmaceuticals, organic products, and materials.

Upstream & downstream products

Suppliers100 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
BAYNOE CHEM CO.,LTD+86-21-34783353 +8615000719740 · [email protected]
杭州奥得科技有限公司0571-88772972-0 15057128248 · [email protected]
上海遐瑞医药科技有限公司+86-021-61551413 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]

Related reactions

4 records
New reaction record

Compound notes

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