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CAS 23077-44-3 6-FLUORO-1H-INDOLE-3-CARBOXYLIC ACID molecular structure lightbox
CAS RN: 23077-44-3

6-FLUORO-1H-INDOLE-3-CARBOXYLIC ACID

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250627 1g In stock Inquiry
Batchno.20250416 250mg In stock Inquiry
Batchno.20250510 50mg In stock Inquiry
Batchno.20250311 5g Out of stock Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260221 50mg / 250mg / 1g / 5g / 10g Out of stock 8-10 business days Inquiry
  • Product code: SSC-112442
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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 23077-44-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Shenzhen Inquiry

23077-44-3 / 6-fluoro-1H-indole-3-carboxylic acid

Standard CAS: 23077-44-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
23077-44-3
Multi CAS
No
Molecular Formula
C9H6FNO2
Molecular Weight
179.150000
Exact Mass
179.038257
SMILES
C1=CC2=C(C=C1F)NC=C2C(=O)O
InChI
InChI=1S/C9H6FNO2/c10-5-1-2-6-7(9(12)13)4-11-8(6)3-5/h1-4,11H,(H,12,13)
InChIKey
ITDFSNLFIZWJDB-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
9
Rotatable bonds
1
H-bond acceptors
1
H-bond donors
2
Molar refractivity
45.22
TPSA
53.09

LogP / Solubility

WLOGP
2.01
MLOGP
1.76
XLogP3
2.1
Consensus LogP
1.96
Log S (ESOL)
-2.66
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.48
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.61
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)
-2.39

Drug-likeness / Medicinal Chemistry

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

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