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CAS 598-64-1 Dimethylammonium Dimethyldithiocarbamate molecular structure lightbox
CAS RN: 598-64-1

Dimethylammonium Dimethyldithiocarbamate

  • Product code: SSC-168362
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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: 5g
  • 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 598-64-1
Pack Size Recorded Purity Available Qty Ship From Inquiry
5g ＞95% 0 Out of Stock Shenzhen Inquiry

598-64-1 / dimethylazanium;N,N-dimethylcarbamodithioate

Standard CAS: 598-64-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
598-64-1
Multi CAS
Yes
Molecular Formula
C5H14N2S2
Molecular Weight
166.300000
Exact Mass
166.059841
InChI
InChI=1S/C3H7NS2.C2H7N/c1-4(2)3(5)6;1-3-2/h1-2H3,(H,5,6);3H,1-2H3
InChIKey
UVOFGKIRTCCNKG-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
0.8
H-bond acceptors
2
H-bond donors
1
Molar refractivity
47.42
TPSA
19.85

LogP / Solubility

WLOGP
-0.81
MLOGP
-0.72
XLogP3
-0.81
Consensus LogP
-0.78
Log S (ESOL)
-0.36
Class (ESOL)
Very soluble
Log S (Ali)
-0.34
Class (Ali)
Very soluble
Log S (SILICOS-IT)
-0.07
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)
-4.31

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

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