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Home > Other Heterocycles > 2060006-04-2
2060006-04-2 | {2-oxabicyclo[2.1.1]hexan-1-yl}methanesulfonyl chloride
CAS No: 2060006-04-2 Catalog No: AG01BYKR MDL No:MFCD30486979
Product Description
Catalog Number:
AG01BYKR
Chemical Name:
{2-oxabicyclo[2.1.1]hexan-1-yl}methanesulfonyl chloride
CAS Number:
2060006-04-2
Molecular Formula:
C6H9ClO3S
Molecular Weight:
196.6519
MDL Number:
MFCD30486979
IUPAC Name:
2-oxabicyclo[2.1.1]hexan-1-ylmethanesulfonyl chloride
InChI:
InChI=1S/C6H9ClO3S/c7-11(8,9)4-6-1-5(2-6)3-10-6/h5H,1-4H2
InChI Key:
CBBHWYZBQOJCMB-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)CC12OCC(C1)C2
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.996g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.645g/mol
Monoisotopic Mass:
195.996g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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