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Home > Other Heterocycles > 2060005-14-1
2060005-14-1 | 7-(butane-1-sulfonyl)-7-azabicyclo[4.1.0]heptane
CAS No: 2060005-14-1 Catalog No: AG01BZ3V MDL No:MFCD30487756
Product Description
Catalog Number:
AG01BZ3V
Chemical Name:
7-(butane-1-sulfonyl)-7-azabicyclo[4.1.0]heptane
CAS Number:
2060005-14-1
Molecular Formula:
C10H19NO2S
Molecular Weight:
217.3284
MDL Number:
MFCD30487756
IUPAC Name:
7-butylsulfonyl-7-azabicyclo[4.1.0]heptane
InChI:
InChI=1S/C10H19NO2S/c1-2-3-8-14(12,13)11-9-6-4-5-7-10(9)11/h9-10H,2-8H2,1H3
InChI Key:
ZECHKVFAPXGWTN-UHFFFAOYSA-N
SMILES:
CCCCS(=O)(=O)N1C2C1CCCC2
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.114g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.327g/mol
Monoisotopic Mass:
217.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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