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Home > Other Heterocycles > 2060005-27-6
2060005-27-6 | 7-(propane-1-sulfonyl)-2-oxa-7-azabicyclo[4.1.0]heptane
CAS No: 2060005-27-6 Catalog No: AG01BZ42 MDL No:MFCD30487763
Product Description
Catalog Number:
AG01BZ42
Chemical Name:
7-(propane-1-sulfonyl)-2-oxa-7-azabicyclo[4.1.0]heptane
CAS Number:
2060005-27-6
Molecular Formula:
C8H15NO3S
Molecular Weight:
205.2746
MDL Number:
MFCD30487763
IUPAC Name:
7-propylsulfonyl-2-oxa-7-azabicyclo[4.1.0]heptane
InChI:
InChI=1S/C8H15NO3S/c1-2-6-13(10,11)9-7-4-3-5-12-8(7)9/h7-8H,2-6H2,1H3
InChI Key:
VJYLBLDCPMQXFH-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)N1C2C1CCCO2
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.272g/mol
Monoisotopic Mass:
205.077g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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