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CAS 6854-07-5 2-Hydroxy-5-nitronicotinic acid molecular structure lightbox
CAS RN: 6854-07-5

2-Hydroxy-5-nitronicotinic acid

  • Product code: SSC-178271
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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
  • Available purity: ≥96%
  • 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 6854-07-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥96% 2 In Stock Hong Kong Inquiry
5g ≥96% 0 Out of Stock Shenzhen Inquiry
10g ≥96% 0 Out of Stock Hong Kong Inquiry
25g ≥96% 0 Out of Stock Hong Kong Inquiry

6854-07-5 / 5-nitro-2-oxo-1H-pyridine-3-carboxylic acid

Standard CAS: 6854-07-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
6854-07-5
Multi CAS
Yes
Molecular Formula
C6H4N2O5
Molecular Weight
184.110000
Exact Mass
184.012021
InChI
InChI=1S/C6H4N2O5/c9-5-4(6(10)11)1-3(2-7-5)8(12)13/h1-2H,(H,7,9)(H,10,11)
InChIKey
JVLVOEQOJYFQKR-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Aromatic heavy atom count
6
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
2
Molar refractivity
40.68
TPSA
113.3

LogP / Solubility

WLOGP
-0.02
MLOGP
-0.02
Consensus LogP
-0.01
Log S (ESOL)
-1.18
Class (ESOL)
Soluble
Log S (Ali)
-1.06
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.08
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.86

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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