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CAS 502-50-1 4-KETOPIMELIC ACID molecular structure lightbox
CAS RN: 502-50-1

4-KETOPIMELIC ACID

Product Availability

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3 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260520 100g Out of stock 5-7 business days Inquiry
Batchno.20260508 25g In stock Shandong Inquiry
Batchno.20250904 5g In stock Shanghai, Shandong Inquiry
  • Product code: SSC-156611
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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 502-50-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ≥97% 0 Out of Stock Shanghai Inquiry

502-50-1 / 4-oxoheptanedioic acid

Standard CAS: 502-50-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
502-50-1
Multi CAS
Yes
Molecular Formula
C7H10O5
Molecular Weight
174.150000
Exact Mass
174.052823
InChI
InChI=1S/C7H10O5/c8-5(1-3-6(9)10)2-4-7(11)12/h1-4H2,(H,9,10)(H,11,12)
InChIKey
UDDSEESQRGPVIL-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.57
Rotatable bonds
6
H-bond acceptors
3
H-bond donors
2
Molar refractivity
38.75
TPSA
91.67

LogP / Solubility

WLOGP
0.29
MLOGP
0.25
XLogP3
-1.2
Consensus LogP
-0.22
Log S (ESOL)
-0.7
Class (ESOL)
Very soluble
Log S (Ali)
-1.19
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.75
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)
-3.58

Drug-likeness / Medicinal Chemistry

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

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