CAS 29583-93-5 2-BroMo-4-Methyl-3-pentanone molecular structure

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CAS RN: 29583-93-5

2-BroMo-4-Methyl-3-pentanone

Product code: SSC-132589

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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

Pack sizes on record: 1g, 5g, 0.1g, 0.25g
Available purity: >95%
Inventory rows with stock: 4
Bulk packaging: confirmed by inquiry

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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 29583-93-5
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	>95%	5 In Stock	Shanghai	Inquiry
5g	>95%	3 In Stock	Shenzhen	Inquiry
0.1g	>95%	1 In Stock	Hong Kong	Inquiry
0.25g	>95%	1 In Stock	Shanghai	Inquiry

29583-93-5 / 2-bromo-4-methylpentan-3-one

Standard CAS: 29583-93-5 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

29583-93-5

Multi CAS

Molecular Formula

C6H11BRO

Molecular Weight

179.050000

Exact Mass

177.999330

InChI

InChI=1S/C6H11BrO/c1-4(2)6(8)5(3)7/h4-5H,1-3H3

InChIKey

MLYRFDXHQSQCKA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

0.83

Rotatable bonds

H-bond acceptors

Molar refractivity

38.23

TPSA

17.07

LogP / Solubility

WLOGP

1.99

MLOGP

1.75

XLogP3

2.2

Consensus LogP

1.98

Log S (ESOL)

-2.07

Class (ESOL)

Moderately soluble

Log S (Ali)

-2.47

Class (Ali)

Moderately soluble

Log S (SILICOS-IT)

-2.72

Class (SILICOS-IT)

Moderately soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.4

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

Applications of CAS 29583-93-5

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 29583-93-5 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

Physical & Chemical Properties

IUPAC Name

2-bromo-4-methylpentan-3-one

Safety Information (GHS)

Pictogram(s): GHS02, GHS05, GHS07. Signal word: Danger.

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
H302+H312 (100%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Precautionary statements: P210, P233, P240, P241, P242, P243, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Request the SDS (Safety Data Sheet) for full hazard and safety documentation.

Storage & Handling

Storage: Keep the container tightly closed in a cool, dry and well-ventilated place. For detailed hazard, storage and transport information, request the SDS (Safety Data Sheet) with your inquiry.

Quotation & Packaging

Prices are confirmed by inquiry. Request a quote for current pricing, minimum order quantity (MOQ) and lead time. The pack sizes listed on this page are reference options; custom pack sizes and bulk quantities are available on request.

Quality & Compliance

Specifications and purity shown on this page are based on batch records. A Certificate of Analysis (COA) is available on request. For research and further manufacturing use only — not for direct human or therapeutic use.