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Iso-Butyl bromide - 98%, high purity , CAS No.78-77-3

2 Citations

COA

Grade & Purity:

≥98%

Cas Number: 78-77-3
Molecular Weight: 137.02
Beilstein Registry Number: 1730915
EC Number: 201-141-2
MDL number: MFCD00000217
PubChem CID: 6555
PubChem SID: 488180094

In stock

Item Number

B105783

Grouped product items
SKU	Size	Availability	Price
B105783-25g	25g	3	$18.90
B105783-100g	100g	5	$64.90
B105783-500g	500g	1	$70.90

View related series

Haloalkane (186) Non heterocyclic block (8163) Organic building blocks (409)

Basic Description

Synonyms	NSC-8416 \| 5OEC0BW987 \| CCRIS 349 \| 1-Bromo-2-methylpropane \| 1-Bromo-2-methyl-propane \| DTXSID1052539 \| MFCD00000217 \| 2-methyl bromopropane \| i-Butyl bromide \| Bromoisobutane \| Propane, 1-bromo-2-methyl- \| ISOBUTYL BROMIDE \| iso-Butyl bromide \| Bromoace
Specifications & Purity	≥98%
Storage Temp	Protected from light,Argon charged
Shipped In	Normal
Product Description	A synthesis reagent for 1-ethyl-1,3-isobutylimidazolium bromide Isobutyl bromide has been used in a reaction with 1-ethylimidazole in a 140 °C oil bath to yield 97% 1-ethyl-1,3-isobutylimidazolium bromide.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Organobromides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Organobromides
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organobromides
Alternative Parents	Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organobromides. These are compounds containing a chemical bond between a carbon atom and a bromine 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	488180094
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488180094
IUPAC Name	1-bromo-2-methylpropane
INCHI	InChI=1S/C4H9Br/c1-4(2)3-5/h4H,3H2,1-2H3
InChIKey	HLVFKOKELQSXIQ-UHFFFAOYSA-N
Smiles	CC(C)CBr
Isomeric SMILES	CC(C)CBr
WGK Germany	3
RTECS	TX4140000
UN Number	2342
Packing Group	II
Molecular Weight	137.02
Beilstein	1730915
Reaxy-Rn	1730915
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730915&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.

20 results found

Lot Number	Certificate Type	Date	Item
E2330143	Certificate of Analysis	Mar 04, 2025	B105783
B2316505	Certificate of Analysis	Nov 12, 2024	B105783
F2503113	Certificate of Analysis	Jul 10, 2024	B105783
F2503121	Certificate of Analysis	Jul 10, 2024	B105783
F2503122	Certificate of Analysis	Jul 10, 2024	B105783
H2204309	Certificate of Analysis	May 17, 2024	B105783
H2204311	Certificate of Analysis	May 17, 2024	B105783
H2204310	Certificate of Analysis	May 17, 2024	B105783
F2420423	Certificate of Analysis	May 17, 2024	B105783
F2420461	Certificate of Analysis	May 17, 2024	B105783
F2420475	Certificate of Analysis	May 17, 2024	B105783
I2103159	Certificate of Analysis	Jun 07, 2023	B105783
I2103161	Certificate of Analysis	Jun 07, 2023	B105783
C2309032	Certificate of Analysis	Mar 14, 2023	B105783
C2309031	Certificate of Analysis	Mar 13, 2023	B105783
D2129291	Certificate of Analysis	Feb 09, 2023	B105783
D2129292	Certificate of Analysis	Feb 09, 2023	B105783
D1926036	Certificate of Analysis	Dec 06, 2022	B105783
G2205156	Certificate of Analysis	Jul 11, 2022	B105783
G2205159	Certificate of Analysis	Jul 08, 2022	B105783

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Chemical and Physical Properties

Solubility	Slightly soluble in water. Miscible with alcohol, ether
Sensitivity	Light & air sensitive.
Refractive Index	1.44
Flash Point(°F)	64.4 °F
Flash Point(°C)	18 °C
Boil Point(°C)	92°C
Melt Point(°C)	-117 °C
Molecular Weight	137.020 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	135.989 Da
Monoisotopic Mass	135.989 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	17.600
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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