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CAS 599-00-8 Trifluoroacetic Acid-d 99.0atom%D molecular structure lightbox
CAS RN: 599-00-8

Trifluoroacetic Acid-d 99.0atom%D

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250604 5g In stock Shanghai, Shandong Inquiry
  • Product code: SSC-168472
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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: ＞98%
  • Inventory rows with stock: 5
  • 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 599-00-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ＞98% 2 In Stock Beijing Inquiry
5g ＞98% 2 In Stock Shanghai Inquiry
10g ＞98% 1 In Stock Hong Kong Inquiry
25g ＞98% 1 In Stock Hong Kong Inquiry
100g ＞98% 1 In Stock Beijing Inquiry

599-00-8 / deuterio 2,2,2-trifluoroacetate

Standard CAS: 599-00-8 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
599-00-8
Multi CAS
Yes
Molecular Formula
C2F3HO2
Molecular Weight
115.030000
Exact Mass
114.999141
InChI
InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)/i/hD
InChIKey
DTQVDTLACAAQTR-DYCDLGHISA-N

Physical Properties

Physical Description
Clear colorless liquid; Hygroscopic
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
0.5
H-bond acceptors
1
H-bond donors
1
Molar refractivity
13.69
TPSA
37.3

LogP / Solubility

WLOGP
0.63
MLOGP
0.55
XLogP3
0.9
Consensus LogP
0.69
Log S (ESOL)
-0.95
Class (ESOL)
Very soluble
Log S (Ali)
-0.95
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.93
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)
-2.97

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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