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Home > Other Heterocycles > 2137854-82-9
2137854-82-9 | {5-oxaspiro[3.4]octan-6-yl}methanesulfonyl chloride
CAS No: 2137854-82-9 Catalog No: AG01EIUZ MDL No:MFCD31438804
Product Description
Catalog Number:
AG01EIUZ
Chemical Name:
{5-oxaspiro[3.4]octan-6-yl}methanesulfonyl chloride
CAS Number:
2137854-82-9
Molecular Formula:
C8H13ClO3S
Molecular Weight:
224.7050
MDL Number:
MFCD31438804
IUPAC Name:
5-oxaspiro[3.4]octan-6-ylmethanesulfonyl chloride
InChI:
InChI=1S/C8H13ClO3S/c9-13(10,11)6-7-2-5-8(12-7)3-1-4-8/h7H,1-6H2
InChI Key:
YPIROZHLPTYHTN-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)CC1CCC2(O1)CCC2
Properties
Complexity:
289
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:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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