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66223-40-3

66223-40-3 | 3-oxa-7-thia-1-azabicyclo[3.3.0]octane

CAS No: 66223-40-3 Catalog No: AG006PC0 MDL No:

Product Description

Catalog Number:
AG006PC0
Chemical Name:
3-oxa-7-thia-1-azabicyclo[3.3.0]octane
CAS Number:
66223-40-3
Molecular Formula:
C5H9NOS
Molecular Weight:
131.1961
IUPAC Name:
3,5,7,7a-tetrahydro-1H-[1,3]thiazolo[3,4-c][1,3]oxazole
InChI:
InChI=1S/C5H9NOS/c1-5-2-8-4-6(5)3-7-1/h5H,1-4H2
InChI Key:
NIWQNVNAIJTMCP-UHFFFAOYSA-N
SMILES:
O1CN2C(C1)CSC2
NSC Number:
271622

Properties

Complexity:
98.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.04g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.193g/mol
Monoisotopic Mass:
131.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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