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α-Ethyl-α-phenylbenzeneacetonitrile

α-Ethyl-α-phenylbenzeneacetonitrile structure

CAS No:
5558-68-9
Formula:
C16H15N
Chemical Name:
α-Ethyl-α-phenylbenzeneacetonitrile
Synonyms:
Benzeneacetonitrile,α-ethyl-α-phenyl-;Butyronitrile,2,2-diphenyl-;α-Ethyl-α-phenylbenzeneacetonitrile;2,2-Diphenylbutyronitrile;NSC 62705;Diphenylbutanenitrile;2,2-Diphenylbutanenitrile

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α-Ethyl-α-phenylbenzeneacetonitrile Basic Attributes

Molecular Weight：

221.30 g/mol

Exact Mass：

221.30

EC Number：

226-926-7

NSC Number：

62705

DSSTox ID：

DTXSID60204128

Characteristics

PSA：

23.8 Å²

Boiling Point：

201 °C @ Press: 17 Torr

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P391, 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:221.30
XLogP3:4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:221.120449483
Monoisotopic Mass:221.120449483
Topological Polar Surface Area:23.8
Heavy Atom Count:17
Complexity:255
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of α-Ethyl-α-phenylbenzeneacetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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