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CAS 77-95-2 D-(-)-Quinic Acid molecular structure lightbox
CAS RN: 77-95-2

D-(-)-Quinic Acid

Product Availability

Choose a grade to view its available package options.

8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251111 100g In stock Shanghai Inquiry
Batchno.20260119 10g In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250519 1g In stock Shanghai, Tianjin Inquiry
Batchno.20251015 1mg In stock Shanghai, Wuhan Inquiry
Batchno.20251214 25g In stock Shanghai, Shenzhen, Chengdu Inquiry
Batchno.20251108 500g In stock Shanghai Inquiry
Batchno.20250909 5g In stock Shanghai, Shenzhen, Tianjin Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250121 5g / 25g / 100g / 500g Confirm by inquiry Shanghai, Shandong, Guangdong, Hebei, Chongqing Inquiry
  • Product code: SSC-186487
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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: 10g
  • 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 77-95-2
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 0 Out of Stock Shenzhen Inquiry

77-95-2 / 1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid

Standard CAS: 77-95-2 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
77-95-2
Multi CAS
Yes
Molecular Formula
C7H12O6
Molecular Weight
192.170000
Exact Mass
192.063388
InChI
InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)
InChIKey
AAWZDTNXLSGCEK-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
13
Fraction Csp3
0.86
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
5
Molar refractivity
39.84
TPSA
118.22

LogP / Solubility

WLOGP
-2.32
MLOGP
-2.04
XLogP3
-2.4
Consensus LogP
-2.25
Log S (ESOL)
0.5
Class (ESOL)
Highly soluble
Log S (Ali)
0.54
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.9
Class (SILICOS-IT)
Highly 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)
-5.54

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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