CAS 1142194-47-5 4-Bromo-2-pyrrolidin-1-ylpyridine molecular structure

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CAS RN: 1142194-47-5

4-Bromo-2-pyrrolidin-1-ylpyridine

Product code: SSC-014087

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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
Available purity: >97%
Inventory rows with stock: 5
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 1142194-47-5
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
0.1g	>97%	1 In Stock	Shanghai	Inquiry
0.25g	>97%	1 In Stock	Shanghai	Inquiry
1g	>97%	1 In Stock	Beijing	Inquiry
5g	>97%	1 In Stock	Hong Kong	Inquiry
10g	>97%	1 In Stock	Shanghai	Inquiry

1142194-47-5 / 4-bromo-2-pyrrolidin-1-ylpyridine

4-Bromo-2-pyrrolidin-1-ylpyridine | 4-bromo-2-(pyrrolidin-1-yl)pyridine | MFCD11869630

Standard CAS: 1142194-47-5 Multi CAS: No

Basic Information Computed Properties

Basic Information

CAS

1142194-47-5

Multi CAS

Molecular Formula

C9H11BrN2

Molecular Weight

227.100000

Exact Mass

226.010560

SMILES

C1CCN(C1)C2=NC=CC(=C2)Br

InChI

InChI=1S/C9H11BrN2/c10-8-3-4-11-9(7-8)12-5-1-2-6-12/h3-4,7H,1-2,5-6H2

InChIKey

POSHCKSYISAKHI-UHFFFAOYSA-N

Synonyms

4-Bromo-2-pyrrolidin-1-ylpyridine 4-bromo-2-(pyrrolidin-1-yl)pyridine MFCD11869630 4-Bromo-2-(1-pyrrolidinyl)pyridine 4-BROMO-2-(PYRROLIDINO)PYRIDINE

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.44

Rotatable bonds

H-bond acceptors

Molar refractivity

53.38

TPSA

16.13

LogP / Solubility

WLOGP

2.44

MLOGP

2.15

XLogP3

2.5

Consensus LogP

2.36

Log S (ESOL)

-3.09

Class (ESOL)

Poorly soluble

Log S (Ali)

-3.19

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.28

Class (SILICOS-IT)

Poorly 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)

-2.37

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Leadlikeness

Synthetic Accessibility

1.5

Applications of CAS 1142194-47-5

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1142194-47-5 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.