CAS 1803587-12-3 4-(4-Bromobutyl)morpholine Hydrobromide molecular structure

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CAS RN: 1803587-12-3

4-(4-Bromobutyl)morpholine Hydrobromide

Product code: SSC-080869

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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, 10g
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 1803587-12-3
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
1g	≥95%	5 In Stock	Beijing	Inquiry
5g	≥95%	3 In Stock	Shanghai	Inquiry
0.1g	≥95%	2 In Stock	Hong Kong	Inquiry
0.25g	≥95%	2 In Stock	Beijing	Inquiry
10g	≥95%	0 Out of Stock	Hong Kong	Inquiry

1803587-12-3 / 4-(4-bromobutyl)morpholine;hydrobromide

Standard CAS: 1803587-12-3 Multi CAS: No

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

1803587-12-3

Multi CAS

Molecular Formula

C8H17Br2NO

Molecular Weight

303.030000

Exact Mass

302.965640

SMILES

C1COCCN1CCCCBr.Br

InChI

InChI=1S/C8H16BrNO.BrH/c9-3-1-2-4-10-5-7-11-8-6-10;/h1-8H2;1H

InChIKey

XKJZEEFMNOLWDM-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Fraction Csp3

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

60.61

TPSA

12.47

LogP / Solubility

WLOGP

2.07

MLOGP

1.84

XLogP3

2.07

Consensus LogP

1.99

Log S (ESOL)

-2.76

Class (ESOL)

Moderately soluble

Log S (Ali)

-3.54

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.83

Class (SILICOS-IT)

Poorly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

CYP2C19 inhibitor

CYP2C9 inhibitor

Yes

CYP2D6 inhibitor

Yes

CYP3A4 inhibitor

Log Kp (skin permeation)

-3.1

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Yes

Synthetic Accessibility

1.5

Safety & Transport

Pictogram(s)

Irritant

Signal

Warning

GHS Hazard Statements

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statement Codes

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

Applications of CAS 1803587-12-3

This compound is commonly used in general chemistry research and laboratory applications. Starshine Chemical supplies CAS 1803587-12-3 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.