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1213183-44-8 molecular structure
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(3S)-3-(furan-3-yl)morpholine

ChemBase ID: 797644
Molecular Formular: C8H11NO2
Molecular Mass: 153.17844
Monoisotopic Mass: 153.0789786
SMILES and InChIs

SMILES:
[C@@H]1(COCCN1)c1cocc1
Canonical SMILES:
C1CN[C@H](CO1)c1cocc1
InChI:
InChI=1S/C8H11NO2/c1-3-10-5-7(1)8-6-11-4-2-9-8/h1,3,5,8-9H,2,4,6H2/t8-/m1/s1
InChIKey:
QRTFXNSVWFBXRX-MRVPVSSYSA-N

Cite this record

CBID:797644 http://www.chembase.cn/molecule-797644.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(3S)-3-(furan-3-yl)morpholine
IUPAC Traditional name
(3S)-3-(furan-3-yl)morpholine
Synonyms
(S)-3-(Furan-3-yl)Morpholine
CAS Number
1213183-44-8

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O9316 external link Add to cart
Data Source Data ID Price
A&J Pharmtech
AJA-O9316 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) -1.119486  LogD (pH = 7.4) 0.32545146 
Log P 0.51310676  Molar Refractivity 40.5641 cm3
Polarizability 16.053087 Å3 Polar Surface Area 34.4 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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