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1209587-37-0 molecular structure
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4-(1-methoxypropan-2-yl)piperidine

ChemBase ID: 308901
Molecular Formular: C9H19NO
Molecular Mass: 157.25326
Monoisotopic Mass: 157.14666423
SMILES and InChIs

SMILES:
N1CCC(C(COC)C)CC1
Canonical SMILES:
COCC(C1CCNCC1)C
InChI:
InChI=1S/C9H19NO/c1-8(7-11-2)9-3-5-10-6-4-9/h8-10H,3-7H2,1-2H3
InChIKey:
CLHALIZKGLFJAS-UHFFFAOYSA-N

Cite this record

CBID:308901 http://www.chembase.cn/molecule-308901.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-(1-methoxypropan-2-yl)piperidine
IUPAC Traditional name
4-(1-methoxypropan-2-yl)piperidine
Synonyms
4-(2-methoxy-1-methylethyl)piperidine
CAS Number
1209587-37-0
MDL Number
MFCD12827500

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.27107  LogD (pH = 7.4) -1.8141558 
Log P 0.9604961  Molar Refractivity 47.1365 cm3
Polarizability 18.799707 Å3 Polar Surface Area 21.26 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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