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CAS 54-20-6 5-(Trifluoromethyl)uracil molecular structure lightbox
CAS RN: 54-20-6

5-(Trifluoromethyl)uracil

  • Product code: SSC-161473
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 25g, 100g
  • Available purity: ≥97%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 54-20-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 5 In Stock Hong Kong Inquiry
5g ≥97% 5 In Stock Shenzhen Inquiry
10g ≥97% 4 In Stock Beijing Inquiry
25g ≥97% 4 In Stock Beijing Inquiry
100g ≥97% 0 Out of Stock Shanghai Inquiry

54-20-6 / 5-(trifluoromethyl)-1H-pyrimidine-2,4-dione

Standard CAS: 54-20-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
54-20-6
Multi CAS
Yes
Molecular Formula
C5F3H3N2O2
Molecular Weight
180.080000
Exact Mass
180.014662
InChI
InChI=1S/C5H3F3N2O2/c6-5(7,8)2-1-9-4(12)10-3(2)11/h1H,(H2,9,10,11,12)
InChIKey
LMNPKIOZMGYQIU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Aromatic heavy atom count
6
Fraction Csp3
0.2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
32.69
TPSA
65.72

LogP / Solubility

WLOGP
0.08
MLOGP
0.07
Consensus LogP
0.05
Log S (ESOL)
-1.38
Class (ESOL)
Soluble
Log S (Ali)
-1.1
Class (Ali)
Soluble
Log S (SILICOS-IT)
-0.9
Class (SILICOS-IT)
Very 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)
-3.76

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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