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Home > Encyclopedia > diethyl 2-(benzotriazol-1-ylimino)propanedioate

diethyl 2-(benzotriazol-1-ylimino)propanedioate

diethyl 2-(benzotriazol-1-ylimino)propanedioate structure

diethyl 2-(benzotriazol-1-ylimino)propanedioate 

structure
  • CAS No:

    100796-79-0

  • Formula:

    C13H14N4O4

  • Chemical Name:

    diethyl 2-(benzotriazol-1-ylimino)propanedioate

  • Synonyms:

    benzotriazol-1-ylimino-malonic acid diethyl ester; diethyl 2-(benzotriazolylazamethylene)propane-1,3-dioate; Diaethyl-mesoxyliden-1-amino-benzotriazol; Diethyl (1H-Benzotriazol-1-yl)Iminomalonate;

diethyl 2-(benzotriazol-1-ylimino)propanedioate Basic Attributes

290.27500

290.10150494

DTXSID60401877

2933990090

Characteristics

95.67000

0.76160

1.34g/cm3

99-100ºC

413ºC

203.6ºC

1.608

4.97E-07mmHg at 25°C

Safety Information

S22-S24/25

|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:290.27
XLogP3:2.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:7
Exact Mass:290.10150494
Monoisotopic Mass:290.10150494
Topological Polar Surface Area:95.7
Heavy Atom Count:21
Complexity:406
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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