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Home > Other Heterocycles > 2060057-60-3
2060057-60-3 | {1-azabicyclo[3.3.1]nonan-5-yl}methanesulfonyl chloride
CAS No: 2060057-60-3 Catalog No: AG01BO19 MDL No:MFCD30498595
Product Description
Catalog Number:
AG01BO19
Chemical Name:
{1-azabicyclo[3.3.1]nonan-5-yl}methanesulfonyl chloride
CAS Number:
2060057-60-3
Molecular Formula:
C9H16ClNO2S
Molecular Weight:
237.7468
MDL Number:
MFCD30498595
IUPAC Name:
1-azabicyclo[3.3.1]nonan-5-ylmethanesulfonyl chloride
InChI:
InChI=1S/C9H16ClNO2S/c10-14(12,13)8-9-3-1-5-11(7-9)6-2-4-9/h1-8H2
InChI Key:
NVPVLTAKYACXLX-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)CC12CCCN(C2)CCC1
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.742g/mol
Monoisotopic Mass:
237.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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