[email protected]
CAS 55764-23-3 2,5-Dimethyl-3-furanthiol molecular structure lightbox
CAS RN: 55764-23-3

2,5-Dimethyl-3-furanthiol

Product Availability

Choose a grade to view its available package options.

4 package records1 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260407 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Guangdong 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251102 1g Out of stock Inquiry
Batchno.20250529 25g Out of stock Inquiry
Batchno.20250401 5g Out of stock Inquiry
  • Product code: ICTD3764
  • Purity/Analytical Methods: >97.0%(GC)
GET A QUOTE

55764-23-3 / 2,5-dimethylfuran-3-thiol

Standard CAS: 55764-23-3 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
55764-23-3
Multi CAS
Yes
Molecular Formula
C6H8OS
Molecular Weight
128.190000
Exact Mass
128.029586
InChI
InChI=1S/C6H8OS/c1-4-3-6(8)5(2)7-4/h3,8H,1-2H3
InChIKey
DBBHCZMXKBCICL-UHFFFAOYSA-N

Physical Properties

Boiling Point
175.00 to 177.00 °C. @ 760.00 mm Hg
Density
1.138-1.144
Physical Description
Clear yellow-orange liquid; meaty aroma
State
Liquid

Computed Properties

Structural Parameters

Heavy atom count
8
Aromatic heavy atom count
5
Fraction Csp3
0.33
H-bond acceptors
2
H-bond donors
1
Molar refractivity
35.43
TPSA
13.14

LogP / Solubility

WLOGP
2.19
MLOGP
1.91
XLogP3
1.9
Consensus LogP
2
Log S (ESOL)
-2.47
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.19
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.31
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)
-1.95

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us