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1215537-22-6 molecular structure
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2,2,6,6-tetramethyl(1-15N)piperidin-4-amine

ChemBase ID: 160493
Molecular Formular: C9H20N2
Molecular Mass: 157.2619089
Monoisotopic Mass: 157.15968354
SMILES and InChIs

SMILES:
C1(CC([15NH]C(C1)(C)C)(C)C)N
Canonical SMILES:
NC1CC(C)(C)[15NH]C(C1)(C)C
InChI:
InChI=1S/C9H20N2/c1-8(2)5-7(10)6-9(3,4)11-8/h7,11H,5-6,10H2,1-4H3/i11+1
InChIKey:
FTVFPPFZRRKJIH-KHWBWMQUSA-N

Cite this record

CBID:160493 http://www.chembase.cn/molecule-160493.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2,2,6,6-tetramethyl(1-15N)piperidin-4-amine
IUPAC Traditional name
2,2,6,6-tetramethyl(1-15N)piperidin-4-amine
Synonyms
4-Amino-2,2,6,6-tetramethylpiperidine-1-15N
CAS Number
1215537-22-6
PubChem SID
162254628
PubChem CID
46780359

DATA SOURCES

DATA SOURCES

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Data Source Data ID
TRC A630240 external link Add to cart
PubChem 46780359 external link
Data Source Data ID Price
TRC
A630240 external link Add to cart Please log in.
Data Source Data ID
PubChem 46780359 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -5.373344  LogD (pH = 7.4) -3.4947853 
Log P 0.41260272  Molar Refractivity 48.1892 cm3
Polarizability 19.657892 Å3 Polar Surface Area 38.05 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Dichloromethane expand Show data source
Ethyl Acetate expand Show data source
Methanol expand Show data source
Apperance
Pale Yellow Oil expand Show data source
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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