2,5-Dimethylbenzothiazole
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2,5-Dimethylbenzothiazole
structure -
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CAS No:
95-26-1
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Formula:
C9H9NS
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Chemical Name:
2,5-Dimethylbenzothiazole
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Synonyms:
Benzothiazole,2,5-dimethyl-;2,5-Dimethylbenzothiazole;2,5-Dimethyl-1,3-benzothiazole
- Categories:
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CAS No:
2,5-Dimethylbenzothiazole Basic Attributes
163.238
163.24
202-404-4
F8YB2EH8TU
DTXSID9059121
2934999090
Characteristics
41.1
2.91310
1.176 g/cm3
172-173 °C
142-146 °C @ Press: 10 Torr
>230 °F
1.643
LD50 orally in Rabbit: 957 mg/kg
Safety Information
3
R22;R36/37/38
S26-S36
DL3675000
Xn:Harmful;
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501
H302
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:163.24
XLogP3:3.1
Hydrogen Bond Acceptor Count:2
Exact Mass:163.04557046
Monoisotopic Mass:163.04557046
Topological Polar Surface Area:41.1
Heavy Atom Count:11
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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