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CAS 98197-88-7 CHEMPACIFIC 38139 molecular structure lightbox
CAS RN: 98197-88-7

CHEMPACIFIC 38139

Product Availability

Choose a grade to view its available package options.

5 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260523 100mg In stock Shanghai Inquiry
Batchno.20260106 1g In stock Shenzhen Inquiry
Batchno.20250415 250mg In stock Shanghai Inquiry
Batchno.20250905 25g Out of stock Inquiry
Batchno.20250708 5g Out of stock Inquiry
  • Product code: SSC-212589
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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: 0.25g, 0.1g, 1g, 5g
  • 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 98197-88-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
0.25g >97% 2 In Stock Shenzhen Inquiry
0.1g >97% 0 Out of Stock Beijing Inquiry
1g >97% 0 Out of Stock Shanghai Inquiry
5g >97% 0 Out of Stock Shenzhen Inquiry

98197-88-7 / (4-nitro-2-pyridinyl)methanol

Standard CAS: 98197-88-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
98197-88-7
Multi CAS
Yes
Molecular Formula
C6H6N2O3
Molecular Weight
154.120000
Exact Mass
154.037842
InChI
InChI=1S/C6H6N2O3/c9-4-5-3-6(8(10)11)1-2-7-5/h1-3,9H,4H2
InChIKey
HFSUHEWRFBAVHH-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
11
Aromatic heavy atom count
6
Fraction Csp3
0.17
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
36.81
TPSA
76.26

LogP / Solubility

WLOGP
0.48
MLOGP
0.42
XLogP3
-0.2
Consensus LogP
0.23
Log S (ESOL)
-1.37
Class (ESOL)
Soluble
Log S (Ali)
-1.17
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.3
Class (SILICOS-IT)
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)
-3.32

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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