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CAS 34702-59-5 Pentafluoro-L-phenylalanine molecular structure lightbox
CAS RN: 34702-59-5

Pentafluoro-L-phenylalanine

Product Availability

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6 package records6 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260508 100mg In stock Shanghai, Wuhan Inquiry
Batchno.20260603 100mg / 250mg / 1g Confirm by inquiry Shanghai, Guangdong Inquiry
Batchno.20260301 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250915 250mg In stock Shanghai Inquiry
Batchno.20251012 25g In stock Shanghai Inquiry
Batchno.20251004 5g In stock Shanghai Inquiry
  • Product code: SSC-141301
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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 34702-59-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

34702-59-5 / 2-amino-3-(2,3,4,5,6-pentafluorophenyl)propanoic acid

Standard CAS: 34702-59-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34702-59-5
Multi CAS
Yes
Molecular Formula
C9F5H6NO2
Molecular Weight
255.140000
Exact Mass
255.031869
InChI
InChI=1S/C9H6F5NO2/c10-4-2(1-3(15)9(16)17)5(11)7(13)8(14)6(4)12/h3H,1,15H2,(H,16,17)
InChIKey
YYTDJPUFAVPHQA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.22
Rotatable bonds
3
H-bond acceptors
2
H-bond donors
2
Molar refractivity
45.55
TPSA
63.32

LogP / Solubility

WLOGP
1.34
MLOGP
1.18
XLogP3
-0.9
Consensus LogP
0.54
Log S (ESOL)
-2.33
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.62
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.79
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
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.33

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

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