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CAS 450-62-4 7-(Trifluoromethyl)-1,2,3,4-tetrahydroquinoline molecular structure lightbox
CAS RN: 450-62-4

7-(Trifluoromethyl)-1,2,3,4-tetrahydroquinoline

Product Availability

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4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250629 1g In stock Inquiry
Batchno.20250303 250mg In stock Inquiry
Batchno.20250128 50mg In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260212 250mg In stock Shanghai, Shandong Inquiry
  • Product code: SSC-152874
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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: ＞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 450-62-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞97% 0 Out of Stock Hong Kong Inquiry

450-62-4 / 7-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline

Standard CAS: 450-62-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
450-62-4
Multi CAS
Yes
Molecular Formula
C10F3H10N
Molecular Weight
201.190000
Exact Mass
201.076534
InChI
InChI=1S/C10H10F3N/c11-10(12,13)8-4-3-7-2-1-5-14-9(7)6-8/h3-4,6,14H,1-2,5H2
InChIKey
RGZZKZNESVFQKR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.4
H-bond acceptors
1
H-bond donors
1
Molar refractivity
48.25
TPSA
12.03

LogP / Solubility

WLOGP
3.06
MLOGP
2.7
XLogP3
3.2
Consensus LogP
2.99
Log S (ESOL)
-3.33
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.42
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.51
Class (SILICOS-IT)
Poorly 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)
-1.77

Drug-likeness / Medicinal Chemistry

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

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