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Home > Other Heterocycles > 2059931-77-8
2059931-77-8 | 7-(ethanesulfonyl)-2-oxa-7-azabicyclo[4.1.0]heptane
CAS No: 2059931-77-8 Catalog No: AG01BZ41 MDL No:MFCD30487762
Product Description
Catalog Number:
AG01BZ41
Chemical Name:
7-(ethanesulfonyl)-2-oxa-7-azabicyclo[4.1.0]heptane
CAS Number:
2059931-77-8
Molecular Formula:
C7H13NO3S
Molecular Weight:
191.2480
MDL Number:
MFCD30487762
IUPAC Name:
7-ethylsulfonyl-2-oxa-7-azabicyclo[4.1.0]heptane
InChI:
InChI=1S/C7H13NO3S/c1-2-12(9,10)8-6-4-3-5-11-7(6)8/h6-7H,2-5H2,1H3
InChI Key:
ACJAOFXTGOKGRY-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)N1C2C1CCCO2
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.062g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.245g/mol
Monoisotopic Mass:
191.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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