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CAS 14590-54-6 (1S,2S)-CYCLOPROPANE-1,2-DICARBOXYLIC ACID molecular structure lightbox
CAS RN: 14590-54-6

(1S,2S)-CYCLOPROPANE-1,2-DICARBOXYLIC ACID

Product Availability

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250925 100mg In stock Shanghai Inquiry
Batchno.20250723 1g In stock Shanghai Inquiry
Batchno.20260629 250mg In stock Shanghai Inquiry
Batchno.20250615 250mg / 1g Out of stock 8-10 business days Inquiry
Batchno.20260604 5g In stock Shanghai Inquiry
  • Product code: SSC-057066
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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 14590-54-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

14590-54-6 / trans-(1S,2S)-cyclopropane-1,2-dicarboxylic acid

Standard CAS: 14590-54-6 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
14590-54-6
Multi CAS
No
Molecular Formula
C5H6O4
Molecular Weight
130.100000
Exact Mass
130.026609
SMILES
C1[C@@H]([C@H]1C(=O)O)C(=O)O
InChI
InChI=1S/C5H6O4/c6-4(7)2-1-3(2)5(8)9/h2-3H,1H2,(H,6,7)(H,8,9)/t2-,3-/m0/s1
InChIKey
RLWFMZKPPHHHCB-HRFVKAFMSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.6
Rotatable bonds
2
H-bond acceptors
2
H-bond donors
2
Molar refractivity
26.87
TPSA
74.6

LogP / Solubility

WLOGP
-0.21
MLOGP
-0.19
XLogP3
-0.6
Consensus LogP
-0.33
Log S (ESOL)
-0.38
Class (ESOL)
Very soluble
Log S (Ali)
-0.48
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.57
Class (SILICOS-IT)
Very 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)
-3.66

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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