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1213691-34-9 molecular structure
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(3R)-3-(pyridin-3-yl)morpholine

ChemBase ID: 797611
Molecular Formular: C9H12N2O
Molecular Mass: 164.20438
Monoisotopic Mass: 164.09496301
SMILES and InChIs

SMILES:
[C@H]1(COCCN1)c1cnccc1
Canonical SMILES:
C1CN[C@@H](CO1)c1cccnc1
InChI:
InChI=1S/C9H12N2O/c1-2-8(6-10-3-1)9-7-12-5-4-11-9/h1-3,6,9,11H,4-5,7H2/t9-/m0/s1
InChIKey:
RNOJNTZCFOIEMH-VIFPVBQESA-N

Cite this record

CBID:797611 http://www.chembase.cn/molecule-797611.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(3R)-3-(pyridin-3-yl)morpholine
IUPAC Traditional name
(3R)-3-(pyridin-3-yl)morpholine
Synonyms
(R)-3-(Pyridin-3-yl)Morpholine
CAS Number
1213691-34-9

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O9092 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O9092 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.7590334  LogD (pH = 7.4) -0.16018948 
Log P 0.15518884  Molar Refractivity 45.8938 cm3
Polarizability 18.278748 Å3 Polar Surface Area 34.15 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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