CAS 1082041-34-6 5-Bromo-4-methyl-1H-indazole molecular structure

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CAS RN: 1082041-34-6

5-Bromo-4-methyl-1H-indazole

Product code: SSC-009438

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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: 0.1g, 0.25g, 1g, 5g, 10g, 25g
Available purity: ≥95%
Inventory rows with stock: 2
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 1082041-34-6
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
0.1g	≥95%	2 In Stock	Shanghai	Inquiry
0.25g	≥95%	2 In Stock	Shanghai	Inquiry
1g	≥95%	0 Out of Stock	Shenzhen	Inquiry
5g	≥95%	0 Out of Stock	Hong Kong	Inquiry
10g	≥95%	0 Out of Stock	Hong Kong	Inquiry
25g	≥95%	0 Out of Stock	Hong Kong	Inquiry

1082041-34-6 / 5-bromo-4-methyl-1H-indazole

5-bromo-4-methyl-1H-indazole | DTXSID80657117 | RefChem:102175

Standard CAS: 1082041-34-6 Multi CAS: Yes

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

1082041-34-6

Multi CAS

Yes

Molecular Formula

C8H7BrN2

Molecular Weight

211.060000

Exact Mass

209.979260

SMILES

CC1=C(C=CC2=C1C=NN2)Br

InChI

InChI=1S/C8H7BrN2/c1-5-6-4-10-11-8(6)3-2-7(5)9/h2-4H,1H3,(H,10,11)

InChIKey

QLQQQEUHPBMUCF-UHFFFAOYSA-N

Synonyms

5-bromo-4-methyl-1H-indazole DTXSID80657117 RefChem:102175 DTXCID10607867 813-101-7

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.12

H-bond acceptors

H-bond donors

Molar refractivity

48.53

TPSA

28.68

LogP / Solubility

WLOGP

2.63

MLOGP

2.32

XLogP3

2.6

Consensus LogP

2.52

Log S (ESOL)

-3.41

Class (ESOL)

Poorly soluble

Log S (Ali)

-3.19

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.22

Class (SILICOS-IT)

Poorly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

Yes

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-2.14

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

1.5

Safety & Transport

Pictogram(s)

Corrosive Acute Toxic Irritant

Signal

Danger

GHS Hazard Statements

H301 (40%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (40%): Harmful if swallowed [Warning Acute toxicity, oral] H311 (20%): Toxic in contact with skin [Danger Acute toxicity, dermal] H312 (20%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (60%): Causes skin irritation [Warning Skin corrosion/irritation]

Precautionary Statement Codes

P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501

Applications of CAS 1082041-34-6

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1082041-34-6 for R&D and pilot-scale use, with flexible pack sizes and purity grades available.

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.