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Home > Encyclopedia > N-prop-2-enylbenzotriazole-1-carbothioamide

N-prop-2-enylbenzotriazole-1-carbothioamide

N-prop-2-enylbenzotriazole-1-carbothioamide structure

N-prop-2-enylbenzotriazole-1-carbothioamide 

structure
  • CAS No:

    690634-06-1

  • Formula:

    C10H10N4S

  • Chemical Name:

    N-prop-2-enylbenzotriazole-1-carbothioamide

  • Synonyms:

    benzotriazolyl(prop-2-enylamino)methane-1-thione; allylbenzotriazolecarbothioamide; 1H-BENZOTRIAZOLE-1-CARBOTHIOAMIDE,N-2-PROPEN-1-YL; benzotriazole-1-carbothioic acid allylamide;

N-prop-2-enylbenzotriazole-1-carbothioamide Basic Attributes

218.27800

218.06261751

DTXSID70391775

2933990090

Characteristics

74.83000

1.73080

1.3g/cm3

56-60ºC

317.1ºC

145.6ºC

1.677

Safety Information

R22; R37/38; R41

26-39

Xn

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+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:218.28
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:218.06261751
Monoisotopic Mass:218.06261751
Topological Polar Surface Area:74.8
Heavy Atom Count:15
Complexity:256
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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