[email protected]
CAS 104530-80-5 3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate molecular structure lightbox
CAS RN: 104530-80-5

3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250704 1g In stock Inquiry
Batchno.20260302 250mg In stock Inquiry
Batchno.20250304 5g In stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260614 250mg / 1g / 5g Confirm by inquiry Shandong 8-10 business days Inquiry
  • Product code: SSC-006324
GET A QUOTE
Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 10g, 0.1g, 0.25g
  • Available purity: ≥95%
  • Inventory rows with stock: 3
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 104530-80-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 5 In Stock Hong Kong Inquiry
5g ≥95% 2 In Stock Shenzhen Inquiry
10g ≥95% 1 In Stock Shanghai Inquiry
0.1g ≥95% 0 Out of Stock Hong Kong Inquiry
0.25g ≥95% 0 Out of Stock Beijing Inquiry

104530-80-5 / 4-methylbenzenesulfonic acid;(3S)-oxolan-3-amine

3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate | RefChem:403515 | (5)-(-)-3-Aminotetrahydrofuran-4-toulene-sulfonate

Standard CAS: 104530-80-5 Multi CAS: Yes
Basic Information Computed Properties Safety & Transport

Basic Information

CAS
104530-80-5
Multi CAS
Yes
Molecular Formula
C11H17NO4S
Molecular Weight
259.320000
Exact Mass
259.087829
SMILES
CC1=CC=C(C=C1)S(=O)(=O)O.C1COC[C@H]1N
InChI
InChI=1S/C7H8O3S.C4H9NO/c1-6-2-4-7(5-3-6)11(8,9)10;5-4-1-2-6-3-4/h2-5H,1H3,(H,8,9,10);4H,1-3,5H2/t;4-/m.0/s1
InChIKey
BZXPLADBSZWDIH-VWMHFEHESA-N
Synonyms
3-Furanamine, tetrahydro-, (3S)-, 4-methylbenzenesulfonate RefChem:403515 (5)-(-)-3-Aminotetrahydrofuran-4-toulene-sulfonate (S)-3-Aminotetrahydrofuran tosylate (S)-Tetrahydrofuran-3-amine-4-methylbenzenesulfonate

Computed Properties

Structural Parameters

Heavy atom count
17
Aromatic heavy atom count
6
Fraction Csp3
0.45
Rotatable bonds
1
H-bond acceptors
4
H-bond donors
2
Molar refractivity
64.41
TPSA
89.62

LogP / Solubility

WLOGP
0.98
MLOGP
0.87
XLogP3
0.98
Consensus LogP
0.94
Log S (ESOL)
-2.26
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.28
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
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)
-3.61

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
2

Safety & Transport

GHS Hazard Statements
Not Classified Reported as not meeting GHS hazard criteria by 38 of 38 companies. For more detailed information, please visit ECHA C&L website.

Customers Also Viewed

Get In Touch

Contact Us