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CAS 106034-22-4 (S)-2-AMINO-3-(4-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID molecular structure lightbox
CAS RN: 106034-22-4

(S)-2-AMINO-3-(4-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID

Product Availability

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3 package records1 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250904 100mg / 250mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250831 100mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250816 100mg / 250mg / 1g Out of stock 8-10 business days Inquiry
  • Product code: SSC-007697
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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: 1g
  • 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 106034-22-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

106034-22-4 / (2S)-2-amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid

4-Fluorotryptophan | RefChem:912525 | 4-Fluoro-DL-tryptophan

Standard CAS: 106034-22-4 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
106034-22-4
Multi CAS
Yes
Molecular Formula
C11H11FN2O2
Molecular Weight
222.220000
Exact Mass
222.080456
SMILES
C1=CC2=C(C(=C1)F)C(=CN2)C[C@@H](C(=O)O)N
InChI
InChI=1S/C11H11FN2O2/c12-7-2-1-3-9-10(7)6(5-14-9)4-8(13)11(15)16/h1-3,5,8,14H,4,13H2,(H,15,16)/t8-/m0/s1
InChIKey
DEBQMEYEKKWIKC-QMMMGPOBSA-N
Synonyms
4-Fluorotryptophan RefChem:912525 4-Fluoro-DL-tryptophan 2-amino-3-(4-fluoro-1H-indol-3-yl)propanoic acid MFCD00039689

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
9
Fraction Csp3
0.18
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
3
Molar refractivity
57.57
TPSA
79.11

LogP / Solubility

WLOGP
1.26
MLOGP
1.11
XLogP3
-1.1
Consensus LogP
0.42
Log S (ESOL)
-2.23
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.29
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.51
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.18

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 1 of 1 companies. For more detailed information, please visit ECHA C&L website.

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