CAS 3913-17-5 2-CHLORO-4,8-DIMETHYLQUINOLINE molecular structure

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CAS RN: 3913-17-5

2-CHLORO-4,8-DIMETHYLQUINOLINE

Product Availability

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1 package records1 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20260520	250mg / 1g / 5g / 10g	Confirm by inquiry	Shanghai	5-7 business days	Inquiry

Product code: SSC-146750

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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: 10g
Available purity: ≥95%
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 3913-17-5
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
10g	≥95%	0 Out of Stock	Shanghai	Inquiry

3913-17-5 / 2-chloro-4,8-dimethylquinoline

Standard CAS: 3913-17-5 Multi CAS: Yes

Basic Information Computed Properties

Basic Information

CAS

3913-17-5

Multi CAS

Yes

Molecular Formula

C11H10CLN

Molecular Weight

191.650000

Exact Mass

191.050177

InChI

InChI=1S/C11H10ClN/c1-7-4-3-5-9-8(2)6-10(12)13-11(7)9/h3-6H,1-2H3

InChIKey

UAKXMKQZURGJKF-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Fraction Csp3

0.18

H-bond acceptors

Molar refractivity

56.23

TPSA

12.89

LogP / Solubility

WLOGP

3.51

MLOGP

3.08

XLogP3

3.9

Consensus LogP

3.5

Log S (ESOL)

-3.81

Class (ESOL)

Poorly soluble

Log S (Ali)

-3.66

Class (Ali)

Poorly soluble

Log S (SILICOS-IT)

-3.81

Class (SILICOS-IT)

Poorly soluble

ADME

GI absorption

High

BBB permeant

Yes

P-gp substrate

CYP1A2 inhibitor

Yes

CYP2C19 inhibitor

CYP2C9 inhibitor

CYP2D6 inhibitor

CYP3A4 inhibitor

Log Kp (skin permeation)

-1.4

Drug-likeness / Medicinal Chemistry

Lipinski

Yes

Ghose

Veber

Yes

Egan

Yes

Muegge

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

1.5

2-CHLORO-4,8-DIMETHYLQUINOLINE

Product Availability

Historical Supply Reference

Reference Pack Sizes

3913-17-5 / 2-chloro-4,8-dimethylquinoline

Basic Information

Computed Properties

Structural Parameters

LogP / Solubility

ADME

Drug-likeness / Medicinal Chemistry

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