N-(tert-Butoxycarbonyl)-2-aminoacetonitrile
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N-(tert-Butoxycarbonyl)-2-aminoacetonitrile
structure -
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CAS No:
85363-04-8
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Formula:
C7H12N2O2
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Chemical Name:
N-(tert-Butoxycarbonyl)-2-aminoacetonitrile
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Synonyms:
N-(TERT-BUTOXYCARBONYL)-2-AMINOACETONITRILE;AKOS 91568;Carbamic acid, (cyanomethyl)-, 1,1-dimethylethyl ester (9CI);BOC-2-AMINOACETONITRILE;BOC-GLY-NITRILE;N-BOC-2-Aminoacetonitrile;Carbamic acid, (cyanomethyl)-, 1,1-dimethylethyl ester;N-(cyanomethyl)carbamic acid tert-butyl ester
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CAS No:
N-(tert-Butoxycarbonyl)-2-aminoacetonitrile Basic Attributes
156.18
156.089877630 g/mol
DTXSID50337999
2926909090
Characteristics
62.12000
1.42558
1.1832
53-57 °C(lit.)
186 °C(lit.)
>110ºC
1.4880 (estimate)
9.96±0.46
Safety Information
3
20/21/22
36
Xn
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, 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:156.18
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:156.089877630
Monoisotopic Mass:156.089877630
Topological Polar Surface Area:62.1
Heavy Atom Count:11
Complexity:184
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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