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1-Bromo-2-methyl-1-propene - ≥98%, high purity , CAS No.3017-69-4

COA

Grade & Purity:

≥98%

Cas Number: 3017-69-4
Molecular Weight: 135.00
Beilstein Registry Number: 1733844
MDL number: MFCD00009885
PubChem CID: 98560
PubChem SID: 488187129

In stock

Item Number

B163037

Grouped product items
SKU	Size	Availability	Price
B163037-1g	1g	3	$43.90
B163037-5g	5g	4	$103.90
B163037-25g	25g	5	$344.90
B163037-100g	100g	5	$958.90

Basic Description

Synonyms	1-Bromo-2-methylprophene \| 1-Propene, 1-bromo-2-methyl- \| ethyl sulfate sodium salt \| AKOS015841776 \| sodium;4-propan-2-ylbenzenesulfonate \| DTXSID40184252 \| isobutenyl bromide \| EN300-91906 \| SCHEMBL51629 \| Solu-Medrol \| beta,beta-Dimethylvinylbromide \|
Specifications & Purity	≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	1-Bromo-2-methyl-1-propene has been used in: . preparation of esters of 2,4-dienoic acids via palladium catalyzed reaction with methyl acrylate in the presence of triethylamine . total synthesis of ocular age pigment, A2-E . synthesis of 3-nor-geraniol [2H2]

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Vinyl halides
    - Subclass Vinyl bromides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Vinyl halides
Subclass	Vinyl bromides
Intermediate Tree Nodes	Not available
Direct Parent	Vinyl bromides
Alternative Parents	Bromoalkenes Organobromides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Bromoalkene - Haloalkene - Vinyl bromide - Hydrocarbon derivative - Organobromide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as vinyl bromides. These are vinyl halides in which a bromine atom is bonded to an sp2-hybridised carbon atom.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488187129
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488187129
IUPAC Name	1-bromo-2-methylprop-1-ene
INCHI	InChI=1S/C4H7Br/c1-4(2)3-5/h3H,1-2H3
InChIKey	DEFNUDNHTUZJAL-UHFFFAOYSA-N
Smiles	CC(=CBr)C
Isomeric SMILES	CC(=CBr)C
WGK Germany	3
UN Number	1993
Packing Group	II
Molecular Weight	135.00
Beilstein	1733844
Reaxy-Rn	1733844
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1733844&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.

11 results found

Lot Number	Certificate Type	Date	Item
E2316211	Certificate of Analysis	Mar 09, 2023	B163037
E2316210	Certificate of Analysis	Mar 09, 2023	B163037
E2316287	Certificate of Analysis	Mar 09, 2023	B163037
E2316201	Certificate of Analysis	Mar 09, 2023	B163037
E2316206	Certificate of Analysis	Mar 09, 2023	B163037
E2316207	Certificate of Analysis	Mar 09, 2023	B163037
E2316295	Certificate of Analysis	Mar 09, 2023	B163037
E2316213	Certificate of Analysis	Mar 09, 2023	B163037
I2224037	Certificate of Analysis	Jul 18, 2022	B163037
I2224039	Certificate of Analysis	Jul 18, 2022	B163037
I2224038	Certificate of Analysis	Jul 18, 2022	B163037

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Chemical and Physical Properties

Sensitivity	Heat sensitive
Refractive Index	1.462
Flash Point(°F)	44.6 °F
Flash Point(°C)	7 °C
Boil Point(°C)	92 °C
Molecular Weight	135.000 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	133.973 Da
Monoisotopic Mass	133.973 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	41.600
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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