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2-methyl-3-propyl-1,3-benzothiazol-3-ium,iodide

2-methyl-3-propyl-1,3-benzothiazol-3-ium,iodide structure

CAS No:
60126-29-6
Formula:
C11H14INS
Chemical Name:
2-methyl-3-propyl-1,3-benzothiazol-3-ium,iodide
Synonyms:
3-propyl-2-methylbenzothiazolium iodide; N-(1-propyl)-2-methylbenzothiazolium iodide; Benzothiazolium,2-methyl-3-propyl-,iodide; 2-methyl-3-(propyl)benzothiazolium iodide;

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2-methyl-3-propyl-1,3-benzothiazol-3-ium,iodide Basic Attributes

Molecular Weight：

319.20500

Exact Mass：

318.98917

HScode：

2934999090

Characteristics

PSA：

32.12000

XLogP3：

-0.08880

Melting Point：

173-176ºC

Safety Information

hazard class code：

R36/37/38

safety instructions：

26-37/39

Marks：

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:319.21
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:318.98917
Monoisotopic Mass:318.98917
Topological Polar Surface Area:32.1
Heavy Atom Count:14
Complexity:172
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of 2-methyl-3-propyl-1,3-benzothiazol-3-ium,iodide

Basic Attributes
Characteristics
Safety Information
Computed Properties

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