[email protected]
CAS 306936-57-2 3-(4-Fluorophenyl)pyrazole-4-carboxaldehyde molecular structure lightbox
CAS RN: 306936-57-2

3-(4-Fluorophenyl)pyrazole-4-carboxaldehyde

Product Availability

Choose a grade to view its available package options.

5 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250603 10g In stock Inquiry
Batchno.20250622 1g In stock Inquiry
Batchno.20250107 250mg In stock Inquiry
Batchno.20250522 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251027 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-135593
GET A QUOTE
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
Request Bulk Quote

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 306936-57-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

306936-57-2 / 5-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde

Standard CAS: 306936-57-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
306936-57-2
Multi CAS
Yes
Molecular Formula
C10FH7N2O
Molecular Weight
190.170000
Exact Mass
190.054241
InChI
InChI=1S/C10H7FN2O/c11-9-3-1-7(2-4-9)10-8(6-14)5-12-13-10/h1-6H,(H,12,13)
InChIKey
CMXTUUXWJBLVEH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
11
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
49.37
TPSA
45.75

LogP / Solubility

WLOGP
2.03
MLOGP
1.78
XLogP3
1.4
Consensus LogP
1.74
Log S (ESOL)
-2.75
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.58
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.82
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.44

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us