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CAS 37141-01-8 1-Aminobenzene-3,4,5-tricarboxylic acid molecular structure lightbox
CAS RN: 37141-01-8

1-Aminobenzene-3,4,5-tricarboxylic acid

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityInquiry
Batchno.20260120 1g In stock Inquiry
Batchno.20260218 25g Out of stock Inquiry
Batchno.20250106 5g In stock Inquiry
  • Product code: SSC-144471
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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: 1g
  • Available purity: ≥95%
  • 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 37141-01-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

37141-01-8 / 5-aminobenzene-1,2,3-tricarboxylic acid

Standard CAS: 37141-01-8 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
37141-01-8
Multi CAS
No
Molecular Formula
C9H7NO6
Molecular Weight
225.150000
Exact Mass
225.027337
InChI
InChI=1S/C9H7NO6/c10-3-1-4(7(11)12)6(9(15)16)5(2-3)8(13)14/h1-2H,10H2,(H,11,12)(H,13,14)(H,15,16)
InChIKey
DEMLNKQMKMBNIU-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
16
Aromatic heavy atom count
6
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
4
Molar refractivity
51.73
TPSA
137.92

LogP / Solubility

WLOGP
0.36
MLOGP
0.32
XLogP3
-0.2
Consensus LogP
0.16
Log S (ESOL)
-1.54
Class (ESOL)
Soluble
Log S (Ali)
-1.67
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.79
Class (SILICOS-IT)
Soluble

ADME

GI absorption
Low
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)
-3.84

Drug-likeness / Medicinal Chemistry

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

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