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Home > Encyclopedia > 2,5-Dimethylbenzothiazole

2,5-Dimethylbenzothiazole

2,5-Dimethylbenzothiazole structure

2,5-Dimethylbenzothiazole 

structure
  • CAS No:

    95-26-1

  • Formula:

    C9H9NS

  • Chemical Name:

    2,5-Dimethylbenzothiazole

  • Synonyms:

    Benzothiazole,2,5-dimethyl-;2,5-Dimethylbenzothiazole;2,5-Dimethyl-1,3-benzothiazole

  • Categories:

    Organic Chemistry  >  Heterocyclic Ring

Description

white to yellow-brown cryst. low melting solid

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.

2,5-Dimethylbenzothiazole Use and Manufacturing

Benzothiazole, 2,5-dimethyl-: INACTIVE

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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