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Home > Other Heterocycles > 1859558-46-5
1859558-46-5 | 1-{7-oxabicyclo[2.2.1]heptan-2-yl}ethane-1-sulfonyl chloride
CAS No: 1859558-46-5 Catalog No: AG01BM4B MDL No:MFCD31426415
Product Description
Catalog Number:
AG01BM4B
Chemical Name:
1-{7-oxabicyclo[2.2.1]heptan-2-yl}ethane-1-sulfonyl chloride
CAS Number:
1859558-46-5
Molecular Formula:
C8H13ClO3S
Molecular Weight:
224.7050
MDL Number:
MFCD31426415
IUPAC Name:
1-(7-oxabicyclo[2.2.1]heptan-2-yl)ethanesulfonyl chloride
InChI:
InChI=1S/C8H13ClO3S/c1-5(13(9,10)11)7-4-6-2-3-8(7)12-6/h5-8H,2-4H2,1H3
InChI Key:
SLQPZZJVQMPNGV-UHFFFAOYSA-N
SMILES:
CC(S(=O)(=O)Cl)C1CC2OC1CC2
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.699g/mol
Monoisotopic Mass:
224.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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