4-Amino-α-methylbenzeneacetonitrile
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4-Amino-α-methylbenzeneacetonitrile
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CAS No:
28694-90-8
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Formula:
C9H10N2
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Chemical Name:
4-Amino-α-methylbenzeneacetonitrile
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Synonyms:
Benzeneacetonitrile,4-amino-α-methyl-;Hydratroponitrile,p-amino-;4-Amino-α-methylbenzeneacetonitrile;2-(4-Aminophenyl)propionitrile;4-Aminophenyl-α-methylacetonitrile;2-(p-Aminophenyl)propionitrile;2-(4-Aminophenyl)propanenitrile
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CAS No:
Characteristics
49.8
2.47708
1.081g/cm3
55-57°C
130-131 °C @ Press: 0.9 Torr
138.9ºC
1.573
0.000788mmHg at 25°C
Safety Information
IRRITANT
Xi
|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.
4-Amino-α-methylbenzeneacetonitrile Use and Manufacturing
Use benzyl acetonitrile to react with dimethyl sulfate under alkaline conditions to generate 2-phenylpropionitrile, then nitrate and reduce to obtain the product.
Intermediates of flurbiprofen and pirprofen.
Computed Properties
Molecular Weight:146.19
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:146.084398327
Monoisotopic Mass:146.084398327
Topological Polar Surface Area:49.8
Heavy Atom Count:11
Complexity:160
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
- Hot Searches
- cobalt sulfide
- fe3o4
- sicl4
- hexane sds
- furfuryl alcohol
- naclo compound
4-Amino-α-methylbenzeneacetonitrile
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