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CAS 527-17-3 DUROQUINONE molecular structure lightbox
CAS RN: 527-17-3

DUROQUINONE

Product Availability

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2 package records2 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260411 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260622 5g / 25g / 100g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-159806
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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: ≥98%
  • 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 527-17-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥98% 0 Out of Stock Shenzhen Inquiry

527-17-3 / 2,3,5,6-tetramethylcyclohexa-2,5-diene-1,4-dione

Standard CAS: 527-17-3 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
527-17-3
Multi CAS
Yes
Molecular Formula
C10H12O2
Molecular Weight
164.200000
Exact Mass
164.083730
InChI
InChI=1S/C10H12O2/c1-5-6(2)10(12)8(4)7(3)9(5)11/h1-4H3
InChIKey
WAMKWBHYPYBEJY-UHFFFAOYSA-N

Physical Properties

Physical Description
Dark yellow powder
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
12
Fraction Csp3
0.4
H-bond acceptors
2
Molar refractivity
46.76
TPSA
34.14

LogP / Solubility

WLOGP
1.81
MLOGP
1.59
XLogP3
2.2
Consensus LogP
1.87
Log S (ESOL)
-2
Class (ESOL)
Soluble
Log S (Ali)
-2.21
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.23
Class (SILICOS-IT)
Moderately 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)
-2.44

Drug-likeness / Medicinal Chemistry

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

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