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CAS 155-04-4 Zinc 2-Mercaptobenzothiazole molecular structure lightbox
CAS RN: 155-04-4

Zinc 2-Mercaptobenzothiazole

Product Availability

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3 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250301 100g In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251117 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20260529 500g In stock Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
  • Product code: SSC-064302
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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: 100g
  • 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 155-04-4
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ≥95% 0 Out of Stock Beijing Inquiry

155-04-4 / zinc bis(1,3-benzothiazole-2-thiolate)

Standard CAS: 155-04-4 Multi CAS: No
Basic Information Physical Properties Computed Properties Safety & Transport

Basic Information

CAS
155-04-4
Multi CAS
No
Molecular Formula
C14H8N2S4Zn
Molecular Weight
397.900000
Exact Mass
395.886175
SMILES
C1=CC=C2C(=C1)N=C(S2)[S-].C1=CC=C2C(=C1)N=C(S2)[S-].[Zn+2]
InChI
InChI=1S/2C7H5NS2.Zn/c2*9-7-8-5-3-1-2-4-6(5)10-7;/h2*1-4H,(H,8,9);/q;;+2/p-2
InChIKey
PGNWIWKMXVDXHP-UHFFFAOYSA-L

Physical Properties

Density
1.7 AT 25 °C/4 °C
Physical Description
Dry Powder; NKRA Light yellow solid; [HSDB] Cream to pale yellow powder
Appearance
LIGHT YELLOW POWDER
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
21
Aromatic heavy atom count
18
H-bond acceptors
6
Molar refractivity
90.5
TPSA
25.78

LogP / Solubility

WLOGP
4.4
MLOGP
3.9
XLogP3
4.4
Consensus LogP
4.23
Log S (ESOL)
-5.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-6
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-5.9
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.02

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3

Safety & Transport

Pictogram(s)
Irritant Environmental Hazard
Signal
Warning
GHS Hazard Statements
H317 (93.7%): May cause an allergic skin reaction [Warning Sensitization, Skin] H400 (31.7%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard] H410 (36.7%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard] H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement Codes
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, P391, and P501 P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501

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