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2-(1H-indol-3-ylmethylidene)propanedinitrile

2-(1H-indol-3-ylmethylidene)propanedinitrile structure

CAS No:
75629-62-8
Formula:
C12H7N3
Chemical Name:
2-(1H-indol-3-ylmethylidene)propanedinitrile
Synonyms:
75629-62-8;(1h-indol-3-ylmethylene)malononitrile;2-(1H-indol-3-ylmethylidene)propanedinitrile;NSC659143;2-(1H-Indol-3-ylmethylene)malononitrile;(1H-indol-3-ylmethylidene)propanedinitrile;Propanedinitrile,2-(1H-indol-3-ylmethylene)-;2-((1H-Indol-3-yl)methylene)malononitrile;(indol-3-ylmethylene)methane-1,1-dicarbonitrile;2-[(1H-indol-3-yl)methylidene]propanedinitrile;Maybridge1_007156;Indole-Containing Inhibitor 6;BDBM5172;CHEMBL303903;SCHEMBL4328855;HMS561N06;ZINC97348;DTXSID60997063;1,1-dicyano-2-(3-indolyl)ethylene;BBL014229;CCG-49405;MFCD00022740;NSC111033;SBB062265;STK327995;AKOS000640110;2-(Indol-3-ylmethylene)-malononitrile;MCULE-9643859964;MS-6742;NSC-111033;NSC-659143;ALPHA-CYANO-3-INDOLEACRYLONITRILE;NCGC00328900-01;2-(1H-Indole-3-ylmethylene)malononitrile;2-(1H-indol-3-ylmethylene)propanedinitrile;H2929;ST50078890;[(1H-Indol-3-yl)methylidene]propanedinitrile;EN300-24399;AB01111903-04;Propanedinitrile, 2-(1H-indol-3-ylmethylene)-;A838721;AE-641/01119004;SR-01000638862-1;F1589-0579;5154-39-2

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2-(1H-indol-3-ylmethylidene)propanedinitrile Basic Attributes

Molecular Weight：

193.20 g/mol

Exact Mass：

193.063997236 g/mol

NSC Number：

659143|111033

Characteristics

PSA：

63.4 Å²

Safety Information

GHS Classification：

|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:193.20
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:193.063997236
Monoisotopic Mass:193.063997236
Topological Polar Surface Area:63.4
Heavy Atom Count:15
Complexity:347
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1H-indol-3-ylmethylidene)propanedinitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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