1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate
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1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate
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CAS No:
147459-52-7
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Formula:
C10H20N2O2
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Chemical Name:
1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate
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Synonyms:
Carbamic acid,N-(3-methyl-3-pyrrolidinyl)-,1,1-dimethylethyl ester;Carbamic acid,(3-methyl-3-pyrrolidinyl)-,1,1-dimethylethyl ester;1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate;3-Methylpyrrolidin-3-ylcarbamic acid tert-butyl ester;tert-Butyl [3-methylpyrrolidin-3-yl]carbamate;tert-Butyl (3-methylpyrrolidin-3-yl)carbamate;3-[[(tert-Butoxy)carbonyl]amino]-3-methylpyrrolidine
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CAS No:
1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate Basic Attributes
200.278
200.28
DTXSID20445015
2933990090
Safety Information
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate Use and Manufacturing
Benzyl 3-(tert-butoxycarbonylamino)-3-methylpyrrolidine-l-carboxylate(2.00 g, 5.98 mmol) and 10percent Pd/C (0.32 g, 0.30 mmol) in MeOH (20 mL) were stirred under 1 atmosphere of HA solution of tert-butyl i-benzyl-S-methylpyrrolidin-S-ylcarbamate (1.17 g, 4.0 mmol) in EtOH (40 mL) was added to 10% Pd on C and shaken under 45 psi of H2 for 3 h. The mixture was filtered through Celite and concentrated to afford [00257] Step E: Benzyl 3-(tert-butoxycarbonylamino)-3-methylpyrrolidine-l-carboxylate(2.00 g, 5.98 mmol) and 10% Pd/C (0.32 g, 0.30 mmol) in MeOH (20 mL) were stirred under 1 atmosphere of H2 for 1 hour. The catalyst was removed by filtration and washed with methanol.
Computed Properties
Molecular Weight:200.28
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:200.152477885
Monoisotopic Mass:200.152477885
Topological Polar Surface Area:50.4
Heavy Atom Count:14
Complexity:223
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1,1-Dimethylethyl N-(3-methyl-3-pyrrolidinyl)carbamate
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