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CAS 87749-50-6 Tetrabutylammonium fluoride trihydrate molecular structure lightbox
CAS RN: 87749-50-6

Tetrabutylammonium fluoride trihydrate

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260626 100g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260520 1kg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250219 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20260224 500g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-198030
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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: 10g, 25g, 100g, 500g, 1000g
  • Available purity: >95%
  • Inventory rows with stock: 1
  • Bulk packaging: confirmed by inquiry
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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 87749-50-6
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g >95% 5 In Stock Shenzhen Inquiry
25g >95% 0 Out of Stock Beijing Inquiry
100g >95% 0 Out of Stock Beijing Inquiry
500g >95% 0 Out of Stock Shanghai Inquiry
1000g >95% 0 Out of Stock Hong Kong Inquiry

87749-50-6 / tetrabutylazanium;fluoride;trihydrate

Standard CAS: 87749-50-6 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
87749-50-6
Multi CAS
Yes
Molecular Formula
C16FH42NO3
Molecular Weight
315.510000
Exact Mass
315.314872
InChI
InChI=1S/C16H36N.FH.3H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;/h5-16H2,1-4H3;1H;3*1H2/q+1;;;;/p-1
InChIKey
VEPTXBCIDSFGBF-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
21
Fraction Csp3
1
Rotatable bonds
12
H-bond acceptors
4
H-bond donors
3
Molar refractivity
90.2
TPSA
94.5

LogP / Solubility

WLOGP
-0.47
MLOGP
-0.4
XLogP3
-0.47
Consensus LogP
-0.45
Log S (ESOL)
-0.71
Class (ESOL)
Very soluble
Log S (Ali)
-1.81
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.76
Class (SILICOS-IT)
Moderately 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)
-4.98

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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