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3-(3-formylindol-1-yl)propanenitrile

3-(3-formylindol-1-yl)propanenitrile structure

CAS No:
18109-11-0
Formula:
C12H10N2O
Chemical Name:
3-(3-formylindol-1-yl)propanenitrile
Synonyms:
3-(3-Formyl-1H-indol-1-yl)propanenitrile;18109-11-0;3-(3-formylindol-1-yl)propanenitrile;3-(3-Formyl-indol-1-yl)-propionitrile;1H-Indole-1-propanenitrile,3-formyl-;EC-000.1635;SCHEMBL6851183;DTXSID20366271;ZINC2566358;6077AD;BBL004262;MFCD00484155;STL137798;AKOS001057791;MCULE-9494739929;1H-Indole-1-propanenitrile, 3-formyl-;BS-21780;DB-065350;BB 0221236;FT-0691895;EN300-08743;3-(3-Formyl-1H-indol-1-yl)propanenitrile, AldrichCPR

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3-(3-formylindol-1-yl)propanenitrile Basic Attributes

Molecular Weight：

198.22 g/mol

Exact Mass：

198.079312947 g/mol

DSSTox ID：

DTXSID20366271

Characteristics

PSA：

45.8 Å²

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:198.22
XLogP3:1.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:198.079312947
Monoisotopic Mass:198.079312947
Topological Polar Surface Area:45.8
Heavy Atom Count:15
Complexity:281
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3-formylindol-1-yl)propanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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