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CAS 376591-95-6 2-Hydroxy-3”-Nitro-Biphenyl-3-Carboxylic Acid molecular structure lightbox
CAS RN: 376591-95-6

2-Hydroxy-3”-Nitro-Biphenyl-3-Carboxylic Acid

Product Availability

Choose a grade to view its available package options.

7 package records7 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260623 250mg In stock Inquiry
Batchno.20250309 25g In stock Inquiry
Batchno.20260411 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250823 1g In stock Shanghai Inquiry
Batchno.20260614 25g In stock Tianjin, Wuhan Inquiry
Batchno.20250909 5g In stock Shanghai, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260122 1g / 5g / 25g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-145085
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 5g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 376591-95-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞97% 0 Out of Stock Hong Kong Inquiry

376591-95-6 / 3-(2-hydroxy-3-nitrophenyl)benzoic acid

Standard CAS: 376591-95-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
376591-95-6
Multi CAS
Yes
Molecular Formula
C13H9NO5
Molecular Weight
259.210000
Exact Mass
259.048072
InChI
InChI=1S/C13H9NO5/c15-12-10(5-2-6-11(12)14(18)19)8-3-1-4-9(7-8)13(16)17/h1-7,15H,(H,16,17)
InChIKey
JCFPSTQCDAZKJN-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
19
Aromatic heavy atom count
12
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
2
Molar refractivity
67.16
TPSA
100.67

LogP / Solubility

WLOGP
2.67
MLOGP
2.35
XLogP3
3.1
Consensus LogP
2.71
Log S (ESOL)
-3.4
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.61
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.92
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.41

Drug-likeness / Medicinal Chemistry

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

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