3-(3,5-dichlorophenyl)-3-oxopropanenitrile
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3-(3,5-dichlorophenyl)-3-oxopropanenitrile
structure -
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CAS No:
69316-09-2
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Formula:
C9H5Cl2NO
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Chemical Name:
3-(3,5-dichlorophenyl)-3-oxopropanenitrile
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Synonyms:
3-(3,5-dichlorophenyl)-3-oxopropanenitrile;3,5-Dichlorobenzoylacetonitrile;Benzenepropanenitrile, 3,5-dichloro-b-oxo-;PubChem11998;SCHEMBL4945211;CTK5C9410;DTXSID80374150;ZINC2566992;5155AH;MFCD00662057
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CAS No:
3-(3,5-dichlorophenyl)-3-oxopropanenitrile Basic Attributes
214.05
212.974823
DTXSID80374150
2926909090
Safety Information
|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:214.04
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:212.9748192
Monoisotopic Mass:212.9748192
Topological Polar Surface Area:40.9
Heavy Atom Count:13
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(3,5-dichlorophenyl)-3-oxopropanenitrile
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