CAS 71916-82-0 4-Chloro-2-fluorobenzyl Bromide molecular structure

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CAS RN: 71916-82-0

4-Chloro-2-fluorobenzyl Bromide

Product Availability

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1 package records1 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Inquiry
Batchno.20250411	1g / 5g / 25g / 100g / 500g	Confirm by inquiry	Shanghai, Shandong	Inquiry

Product code: SSC-181446

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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

Pack sizes on record: 5g
Available purity: ＞97%
Inventory rows with stock: 0
Bulk packaging: confirmed by inquiry

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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 71916-82-0
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
5g	＞97%	0 Out of Stock	Shanghai	Inquiry

71916-82-0 / 1-(bromomethyl)-4-chloro-2-fluorobenzene

Standard CAS: 71916-82-0 Multi CAS: Yes

Basic Information Computed Properties

Basic Information

CAS

71916-82-0

Multi CAS

Yes

Molecular Formula

C7H5BRCLF

Molecular Weight

223.470000

Exact Mass

221.924720

InChI

InChI=1S/C7H5BrClF/c8-4-5-1-2-6(9)3-7(5)10/h1-3H,4H2

InChIKey

UFCSSWZQROEFBZ-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.14

Rotatable bonds

H-bond acceptors

Molar refractivity

44.04

TPSA

0.0000

LogP / Solubility

WLOGP

3.37

MLOGP

2.97

XLogP3

3.2

Consensus LogP

3.18

Log S (ESOL)

-3.73

Class (ESOL)

Poorly soluble

Log S (Ali)

-3.83

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-4.03

Class (SILICOS-IT)

Slightly 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)

-1.69

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Yes

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

1.5

4-Chloro-2-fluorobenzyl Bromide

Product Availability

Historical Supply Reference

Reference Pack Sizes

71916-82-0 / 1-(bromomethyl)-4-chloro-2-fluorobenzene

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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