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CAS 58914-35-5 2-Formyl-3-(trifluoromethyl)phenol, 2-Formyl-3-hydroxybenzotrifluoride, 6-(Trifluoromethyl)salicylaldehyde molecular structure lightbox
CAS RN: 58914-35-5

2-Formyl-3-(trifluoromethyl)phenol, 2-Formyl-3-hydroxybenzotrifluoride, 6-(Trifluoromethyl)salicylaldehyde

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20251220 100mg / 250mg / 1g / 5g / 10g Out of stock 8-10 business days Inquiry
  • Product code: SSC-167284
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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, 0.25g
  • Available purity: ≥97%
  • Inventory rows with stock: 1
  • 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 58914-35-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥97% 1 In Stock Shenzhen Inquiry
0.25g ≥97% 0 Out of Stock Shenzhen Inquiry

58914-35-5 / 2-hydroxy-6-(trifluoromethyl)benzaldehyde

Standard CAS: 58914-35-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
58914-35-5
Multi CAS
No
Molecular Formula
C8F3H5O2
Molecular Weight
190.120000
Exact Mass
190.024164
InChI
InChI=1S/C8H5F3O2/c9-8(10,11)6-2-1-3-7(13)5(6)4-12/h1-4,13H
InChIKey
DHBICWJRPNXPHO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Fraction Csp3
0.12
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.5
TPSA
37.3

LogP / Solubility

WLOGP
2.22
MLOGP
1.96
XLogP3
2.5
Consensus LogP
2.23
Log S (ESOL)
-2.7
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.72
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.86
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)
-2.3

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5

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