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CAS 598-12-9 1-Methylguanidine Sulfate molecular structure lightbox
CAS RN: 598-12-9

1-Methylguanidine Sulfate

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250522 1g / 5g Confirm by inquiry Shanghai Inquiry
  • Product code: SSC-168350
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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: 25g
  • 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 598-12-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
25g ≥95% 0 Out of Stock Hong Kong Inquiry

598-12-9 / bis(2-methylguanidine);sulfuric acid

Standard CAS: 598-12-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
598-12-9
Multi CAS
Yes
Molecular Formula
C4H16N6O4S
Molecular Weight
244.280000
Exact Mass
244.095374
InChI
InChI=1S/2C2H7N3.H2O4S/c2*1-5-2(3)4;1-5(2,3)4/h2*1H3,(H4,3,4,5);(H2,1,2,3,4)
InChIKey
WTYJBGQERCCGAD-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.5
H-bond acceptors
4
H-bond donors
6
Molar refractivity
57.64
TPSA
203.4

LogP / Solubility

WLOGP
-2.87
MLOGP
-2.52
XLogP3
-2.87
Consensus LogP
-2.75
Log S (ESOL)
0.46
Class (ESOL)
Highly soluble
Log S (Ali)
0.51
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
1.14
Class (SILICOS-IT)
Highly 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)
-6.25

Drug-likeness / Medicinal Chemistry

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

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