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CAS 82358-61-0 Tributyl(cyanomethyl)phosphonium Chloride molecular structure lightbox
CAS RN: 82358-61-0

Tributyl(cyanomethyl)phosphonium Chloride

Product Availability

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4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260102 100g In stock Chengdu Inquiry
Batchno.20260417 1g / 5g / 25g / 100g Confirm by inquiry Shanghai, Shandong Inquiry
Batchno.20250619 25g In stock Shanghai Inquiry
Batchno.20260403 5g In stock Shanghai, Tianjin, Chengdu Inquiry
  • Product code: SSC-190519
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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, 1g, 5g, 25g
  • Available purity: ≥98%
  • Inventory rows with stock: 2
  • 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 82358-61-0
Pack Size Recorded Purity Available Qty Ship From Inquiry
10g ≥98% 3 In Stock Shanghai Inquiry
1g ≥98% 2 In Stock Hong Kong Inquiry
5g ≥98% 0 Out of Stock Shenzhen Inquiry
25g ≥98% 0 Out of Stock Shanghai Inquiry

82358-61-0 / tributyl(cyanomethyl)phosphanium chloride

Standard CAS: 82358-61-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
82358-61-0
Multi CAS
Yes
Molecular Formula
C14H29CLNP
Molecular Weight
277.810000
Exact Mass
277.172615
InChI
InChI=1S/C14H29NP.ClH/c1-4-7-11-16(14-10-15,12-8-5-2)13-9-6-3;/h4-9,11-14H2,1-3H3;1H/q+1;/p-1
InChIKey
JCHWNYYARSRCKZ-UHFFFAOYSA-M

Computed Properties

Structural Parameters

Heavy atom count
17
Fraction Csp3
0.93
Rotatable bonds
10
H-bond acceptors
1
Molar refractivity
76.73
TPSA
23.79

LogP / Solubility

WLOGP
1.93
MLOGP
1.71
XLogP3
1.93
Consensus LogP
1.86
Log S (ESOL)
-2.12
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.23
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-4.27
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.04

Drug-likeness / Medicinal Chemistry

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

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