1-BOC-3-PIPERIDINECARBOXALDEHYDE
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1-BOC-3-PIPERIDINECARBOXALDEHYDE
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CAS No:
118156-93-7
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Formula:
C11H19NO3
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Chemical Name:
1-BOC-3-PIPERIDINECARBOXALDEHYDE
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Synonyms:
N-BOC-3-PIPERIDINYLCARBOXALDEHYDE;N-BOC-3-FORMYLPIPERIDINE;BOC-3-PIPERIDINECARBOXALDEHYDE;BUTTPARK 147\06-01;1-BOC-3-PIPERIDINECARBOXALDEHYDE;1-N-BOC-3-FORMYLPIPERIDINE;3-FORMYLPIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;1-Boc-3-formylpiperidine
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CAS No:
Characteristics
46.6
1.1
1.114±0.06 g/cm3(Predicted)
295.4±33.0 °C(Predicted)
132.5±25.4 °C
1.519
0.002mmHg at 25°C
Safety Information
36/37/38-50-36-22
26-36/37/39-61-37
Xi,N,Xn
|Warning|H302 (16.67%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1-BOC-3-PIPERIDINECARBOXALDEHYDE Use and Manufacturing
DMSO (0.18 mL, 2.6 mmol) in CHDimethylsulphoxide (1.35 ml, 18.8 mmol) was added dropwise to a solution of oxalyl chloride (1.65 ml, 18.8 mmol) in dichloromethane (20 ml) at -78° C. To a solution of compound 21-4-1B (1 g, 4.8 mmol) in DCM (20 mL), Dess-Martin oxidizer (6.1 g, 14.4 mmol) was added in portions, and the resulting solution was stirred at 25° C. for 14 h, followed by quenched with saturated sodium sulfite (NaStep 1.
Computed Properties
Molecular Weight:213.27
XLogP3:1.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:213.13649347
Monoisotopic Mass:213.13649347
Topological Polar Surface Area:46.6
Heavy Atom Count:15
Complexity:245
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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1-BOC-3-PIPERIDINECARBOXALDEHYDE
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