CAS 14290-86-9 4-FLUOROCINNAMIC ACID molecular structure

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CAS RN: 14290-86-9

4-FLUOROCINNAMIC ACID

Product Availability

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3 package records2 with current stock1 grade group

Grade In stock only

Batch No.	Package	Availability	Warehouse	Lead Time	Inquiry
Batchno.20251211	100g	Out of stock		5-7 business days	Inquiry
Batchno.20250910	25g	In stock	Chongqing		Inquiry
Batchno.20260226	5g	In stock	Shanghai, Guangdong		Inquiry

Product code: SSC-054181

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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: 25g
Available purity: ≥98%
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 14290-86-9
Pack Size	Recorded Purity	Available Qty	Ship From	Inquiry
25g	≥98%	0 Out of Stock	Hong Kong	Inquiry

14290-86-9 / (E)-3-(4-fluorophenyl)prop-2-enoic acid

Standard CAS: 14290-86-9 Multi CAS: No

Basic Information Computed Properties Safety & Transport

Basic Information

CAS

14290-86-9

Multi CAS

Molecular Formula

C9H7FO2

Molecular Weight

166.150000

Exact Mass

166.043008

SMILES

C1=CC(=CC=C1/C=C/C(=O)O)F

InChI

InChI=1S/C9H7FO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6H,(H,11,12)/b6-3+

InChIKey

ISMMYAZSUSYVQG-ZZXKWVIFSA-N

Computed Properties

Structural Parameters

Heavy atom count

Aromatic heavy atom count

Rotatable bonds

H-bond acceptors

H-bond donors

Molar refractivity

43.07

TPSA

37.3

LogP / Solubility

WLOGP

1.92

MLOGP

1.69

XLogP3

1.9

Consensus LogP

1.84

Log S (ESOL)

-2.32

Class (ESOL)

Moderately soluble

Log S (Ali)

-2.31

Class (Ali)

Moderately soluble

Log S (SILICOS-IT)

-2.58

Class (SILICOS-IT)

Moderately 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

Bioavailability score

0.55

Brenk alerts

Leadlikeness

Synthetic Accessibility

1.5

Safety & Transport

Pictogram(s)

Acute Toxic Irritant

Signal

Danger Warning

GHS Hazard Statements

H301 (14.3%): Toxic if swallowed [Danger 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 (85.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501