[email protected]
CAS 57981-02-9 O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine Hydrochloride [for Oxime Preparation] molecular structure lightbox
CAS RN: 57981-02-9

O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine Hydrochloride [for Oxime Preparation]

Product Availability

Choose a grade to view its available package options.

1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250306 50mg Out of stock 8-10 business days Inquiry
  • Product code: SSC-166178
GET A QUOTE
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: 0.1g, 1g, 5g, 0.25g, 10g, 25g
  • Available purity: ≥98%
  • Inventory rows with stock: 6
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

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 57981-02-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.1g ≥98% 5 In Stock Hong Kong Inquiry
1g ≥98% 5 In Stock Beijing Inquiry
5g ≥98% 5 In Stock Shanghai Inquiry
0.25g ≥98% 3 In Stock Shanghai Inquiry
10g ≥98% 2 In Stock Shenzhen Inquiry
25g ≥98% 2 In Stock Shenzhen Inquiry

57981-02-9 / O-[(2,3,4,5,6-pentafluorophenyl)methyl]hydroxylamine;hydrochloride

Standard CAS: 57981-02-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
57981-02-9
Multi CAS
Yes
Molecular Formula
C7H5CLF5NO
Molecular Weight
249.560000
Exact Mass
248.997982
InChI
InChI=1S/C7H4F5NO.ClH/c8-3-2(1-14-13)4(9)6(11)7(12)5(3)10;/h1,13H2;1H
InChIKey
HVMVKNXIMUCYJA-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.14
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
1
Molar refractivity
42.46
TPSA
35.25

LogP / Solubility

WLOGP
2.19
MLOGP
1.94
XLogP3
2.19
Consensus LogP
2.11
Log S (ESOL)
-2.93
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.19
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.34
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)
-2.68

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us