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2-Bromo-5-decylthiophene - 97%, high purity , CAS No.514188-72-8

COA

Grade & Purity:

≥97%

Cas Number: 514188-72-8
Molecular Weight: 303.3
PubChem CID: 58892816
PubChem SID: 504771711

In stock

Item Number

B405250

Grouped product items
SKU	Size	Availability	Price
B405250-250mg	250mg	3	$193.90
B405250-1g	1g	3	$539.90
B405250-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$2,229.90

View related series

Halogenated heterocyclic block (1171) thiophenes (401)

Basic Description

Synonyms	DTXSID30730500 \| BLGUNQPKOOEOHU-UHFFFAOYSA-N \| SCHEMBL1756488 \| 2-bromo-5-decylthiophene \| BS-44199 \| T70988 \| B5406 \| MFCD30742895
Specifications & Purity	≥97%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Thiophenes
    - Subclass 2,5-disubstituted thiophenes

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Thiophenes
Subclass	2,5-disubstituted thiophenes
Intermediate Tree Nodes	Not available
Direct Parent	2,5-disubstituted thiophenes
Alternative Parents	Aryl bromides Heteroaromatic compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	2,5-disubstituted thiophene - Aryl halide - Aryl bromide - Heteroaromatic compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as 2,5-disubstituted thiophenes. These are organic compounds containing a thiophene that is disubstituted at the C-2, and C5-positions.
External Descriptors	Not available
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

Names and Identifiers

Pubchem Sid	504771711
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504771711
IUPAC Name	2-bromo-5-decylthiophene
INCHI	InChI=1S/C14H23BrS/c1-2-3-4-5-6-7-8-9-10-13-11-12-14(15)16-13/h11-12H,2-10H2,1H3
InChIKey	BLGUNQPKOOEOHU-UHFFFAOYSA-N
Smiles	CCCCCCCCCCC1=CC=C(S1)Br
Isomeric SMILES	CCCCCCCCCCC1=CC=C(S1)Br
Molecular Weight	303.3
Reaxy-Rn	9400907
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=9400907&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot Number	Certificate Type	Date	Item
J2310256	Certificate of Analysis	Sep 15, 2023	B405250
J2310257	Certificate of Analysis	Sep 15, 2023	B405250
J2310258	Certificate of Analysis	Sep 15, 2023	B405250

Chemical and Physical Properties

Refractive Index	1.51
Flash Point(°C)	160 °C
Boil Point(°C)	135 °C/0.56 mmHg
Molecular Weight	303.300 g/mol
XLogP3	7.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	9
Exact Mass	302.07 Da
Monoisotopic Mass	302.07 Da
Topological Polar Surface Area	28.200 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	161.000
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

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