N-BOC-4-PIPERIDINEACETALDEHYDE
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N-BOC-4-PIPERIDINEACETALDEHYDE
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CAS No:
142374-19-4
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Formula:
C12H21NO3
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Chemical Name:
N-BOC-4-PIPERIDINEACETALDEHYDE
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Synonyms:
1-(tert-butyloxycarbonyl)-piperidine-4-acetaldehyde;tert-Butyl 4-(formylmethyl)piperidine-1-carboxylate;tert-Butyl 4-(2-oxoethyl);n-boc-4-piperidineacetaldehyde;1-PIPERIDINE CARBOXYLIC ACID, 4-(2-OXOETHYL)-1,1-D;1-Boc-4-(2-oxo-ethyl)piperidine;1-PIPERIDINE CARBOXYLIC ACID, 4-(2;tert-butyl 4-(2-oxoethyl)piperidine-1-carboxylate
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CAS No:
Characteristics
46.61000
2.16040
1.035±0.06 g/cm3
38-42 °C
318.1±15.0 °C(Predicted)
146.2ºC
1.467
0mmHg at 25°C
-1.62±0.40
Safety Information
3
36/37/38
26
Xi
P261; P305 + P351 + P338
H315; H319; H335
|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|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
N-BOC-4-PIPERIDINEACETALDEHYDE Use and Manufacturing
N-Boc-4-piperidineacetaldehyde is used in the preparation of benzofuran-2-carboxylic acid based Pim-1 inhibitors.
Computed Properties
Molecular Weight:227.30
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:227.15214353
Monoisotopic Mass:227.15214353
Topological Polar Surface Area:46.6
Heavy Atom Count:16
Complexity:250
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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