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CAS 104-80-3 (Tetrahydrofuran-2,5-diyl)dimethanol (mixture of isomers) molecular structure lightbox
CAS RN: 104-80-3

(Tetrahydrofuran-2,5-diyl)dimethanol (mixture of isomers)

Product Availability

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11 package records9 with current stock3 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250202 1g In stock Inquiry
Batchno.20251019 250mg Out of stock Inquiry
Batchno.20260227 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251005 1g In stock Shanghai, Guangdong Inquiry
Batchno.20250628 250mg In stock Shanghai, Hebei Inquiry
Batchno.20260205 25g Out of stock 8-10 business days Inquiry
Batchno.20250704 5g In stock Shanghai, Shandong Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250426 10g In stock Shanghai Inquiry
Batchno.20250803 1g In stock Shanghai, Tianjin Inquiry
Batchno.20250722 250mg In stock Shanghai Inquiry
Batchno.20250503 5g In stock Shanghai Inquiry
  • Product code: SSC-005751
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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 104-80-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Beijing Inquiry

104-80-3 / [5-(hydroxymethyl)oxolan-2-yl]methanol

2,5-Bis(hydroxymethyl)tetrahydrofuran | 2,5-Tetrahydrofurandimethanol | Tetrahydro-2,5-furandimethanol

Standard CAS: 104-80-3 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
104-80-3
Multi CAS
Yes
Molecular Formula
C6H12O3
Molecular Weight
132.160000
Exact Mass
132.078644
SMILES
C1CC(OC1CO)CO
InChI
InChI=1S/C6H12O3/c7-3-5-1-2-6(4-8)9-5/h5-8H,1-4H2
InChIKey
YCZZQSFWHFBKMU-UHFFFAOYSA-N
Synonyms
2,5-Bis(hydroxymethyl)tetrahydrofuran 2,5-Tetrahydrofurandimethanol Tetrahydro-2,5-furandimethanol 2,5-Anhydro-3,4-dideoxyhexitol NSC 40741

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
32.07
TPSA
49.69

LogP / Solubility

WLOGP
-0.48
MLOGP
-0.43
XLogP3
-0.7
Consensus LogP
-0.54
Log S (ESOL)
-0.22
Class (ESOL)
Very soluble
Log S (Ali)
-0.3
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.36
Class (SILICOS-IT)
Very soluble

ADME

GI absorption
Low
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)
-3.87

Drug-likeness / Medicinal Chemistry

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

Safety & Transport

Pictogram(s)
Irritant
Signal
Warning
GHS Hazard Statements
H315: Causes skin irritation [Warning Skin corrosion/irritation] H319: Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335: May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Precautionary Statement Codes
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

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