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Home > Other Heterocycles > 6714-41-6

6714-41-6

6714-41-6 | 6-oxa-2-azabicyclo[3.2.1]octan-7-one

CAS No: 6714-41-6 Catalog No: AG01DQBL MDL No:MFCD22741640

Product Description

Catalog Number:
AG01DQBL
Chemical Name:
6-oxa-2-azabicyclo[3.2.1]octan-7-one
CAS Number:
6714-41-6
Molecular Formula:
C6H9NO2
Molecular Weight:
127.1412
MDL Number:
MFCD22741640
IUPAC Name:
6-oxa-2-azabicyclo[3.2.1]octan-7-one
InChI:
InChI=1S/C6H9NO2/c8-6-5-3-4(9-6)1-2-7-5/h4-5,7H,1-3H2
InChI Key:
DHSZLJIGOXYLPS-UHFFFAOYSA-N
SMILES:
O=C1OC2CC1NCC2

Properties

Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.063g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.143g/mol
Monoisotopic Mass:
127.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

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