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Home > Encyclopedia > CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-

CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-

CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE- structure

CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE- 

structure
  • CAS No:

    52749-17-4

  • Formula:

    C10H9NO2S **

  • Chemical Name:

    CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-

  • Synonyms:

    CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-;2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazolium hydroxide inner salt;carboxymethylmethylbenzothiazolylidene-me-butenyl;CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE-M E-BUTENYL-ET-ME-BENZOTHIAZOLIUM HYDROX;carbomethylmethylbenzothiazolylidene me-butenyl-et-me-benz;2-[2-[3-(Carboxymethyl)-5-methyl-2(3H)-benzothiazolylidenemethyl]-1-butenyl]-3-ethyl-5-methylbenzothiazoliumhydroxideinnersalt

CARBOXYMETHYLMETHYLBENZOTHIAZOLYLIDENE- Basic Attributes

207.24896

450.14400

Characteristics

105.42000

4.14680

160 °C (dec.)(lit.)

Safety Information

3

36/37/38

26-36

Xi

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|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:450.6
XLogP3:8.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:450.14357042
Monoisotopic Mass:450.14357042
Topological Polar Surface Area:101
Heavy Atom Count:31
Complexity:719
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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