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867034-25-1 molecular structure
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tert-butyl 4-(aminooxy)piperidine-1-carboxylate

ChemBase ID: 290863
Molecular Formular: C10H20N2O3
Molecular Mass: 216.2774
Monoisotopic Mass: 216.14739251
SMILES and InChIs

SMILES:
O=C(N1CCC(ON)CC1)OC(C)(C)C
Canonical SMILES:
NOC1CCN(CC1)C(=O)OC(C)(C)C
InChI:
InChI=1S/C10H20N2O3/c1-10(2,3)14-9(13)12-6-4-8(15-11)5-7-12/h8H,4-7,11H2,1-3H3
InChIKey:
QMTOYSDJBBDOSV-UHFFFAOYSA-N

Cite this record

CBID:290863 http://www.chembase.cn/molecule-290863.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tert-butyl 4-(aminooxy)piperidine-1-carboxylate
IUPAC Traditional name
tert-butyl 4-(aminooxy)piperidine-1-carboxylate
Synonyms
tert-Butyl 4-(aminooxy)piperidine-1-carboxylate
CAS Number
867034-25-1
PubChem SID
180676394
PubChem CID
24729482

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Bide Pharmatech
BD230271 Please log in.
Data Source Data ID
PubChem 24729482 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.5431877  LogD (pH = 7.4) 0.5641418 
Log P 0.5644156  Molar Refractivity 57.4825 cm3
Polarizability 22.572815 Å3 Polar Surface Area 64.79 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
95+% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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