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CAS 70005-88-8 (R)-1,2,4-Butanetriol molecular structure lightbox
CAS RN: 70005-88-8

(R)-1,2,4-Butanetriol

Product Availability

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2 package records2 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260318 1g In stock Shanghai, Shandong, Hebei Inquiry
Batchno.20250625 5g In stock Shandong Inquiry
  • Product code: SSC-179793
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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: ≥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 70005-88-8
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥97% 0 Out of Stock Hong Kong Inquiry

70005-88-8 / butane-1,2,4-triol

Standard CAS: 70005-88-8 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
70005-88-8
Multi CAS
Yes
Molecular Formula
C4H10O3
Molecular Weight
106.120000
Exact Mass
106.062994
InChI
InChI=1S/C4H10O3/c5-2-1-4(7)3-6/h4-7H,1-3H2
InChIKey
ARXKVVRQIIOZGF-UHFFFAOYSA-N

Physical Properties

Physical Description
Colorless to yellow liquid, miscible in water
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
7
Fraction Csp3
1
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
3
Molar refractivity
24.8
TPSA
60.69

LogP / Solubility

WLOGP
-1.28
MLOGP
-1.14
XLogP3
-1.4
Consensus LogP
-1.27
Log S (ESOL)
0.51
Class (ESOL)
Highly soluble
Log S (Ali)
0.49
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
0.35
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)
-4.27

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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