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tert-butyl N-[[1-[(E)-N'-hydroxycarbamimidoyl]piperidin-4-yl]methyl]carbamate (HCID 178453097)|Huagongshe
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Compound
tert-butyl N-[[1-[(E)-N'-hydroxycarbamimidoyl]piperidin-4-yl]methyl]carbamate
HCID
178453097
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Basic information
Names & identifiers
Properties
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Compound notes
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Basic information
Standard SMILES
CC(C)(C)OC(=O)NCC1CCN(C(=N)NO)CC1
InChIKey
OJAVRIWSVJMBHM-UHFFFAOYSA-N
Molecular formula
C12H24N4O3
Average molar mass
272.34 g/mol
Monoisotopic mass
272.18484064
Names & identifiers
Preferred name
tert-butyl N-[[1-[(E)-N'-hydroxycarbamimidoyl]piperidin-4-yl]methyl]carbamate
IUPAC
tert-butyl N-[[1-[(E)-N'-hydroxycarbamimidoyl]piperidin-4-yl]methyl]carbamate
Database identifiers
PubChem CID
23396325
Properties
Computed structural properties
XLogP
0.9
Topological polar surface area
100 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
19
Formal charge
0
Complexity
330
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Related reactions
1 records
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As product
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As solvent
HRID
1831802
As product
uspto-grants-2006_06
Compound notes
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