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Home > Other Heterocycles > 1849364-99-3
1849364-99-3 | 5-oxaspiro[3.5]nonane-8-thiol
CAS No: 1849364-99-3 Catalog No: AG01DT0E MDL No:MFCD30176077
Product Description
Catalog Number:
AG01DT0E
Chemical Name:
5-oxaspiro[3.5]nonane-8-thiol
CAS Number:
1849364-99-3
Molecular Formula:
C8H14OS
Molecular Weight:
158.2612
MDL Number:
MFCD30176077
IUPAC Name:
5-oxaspiro[3.5]nonane-8-thiol
InChI:
InChI=1S/C8H14OS/c10-7-2-5-9-8(6-7)3-1-4-8/h7,10H,1-6H2
InChI Key:
BYWVDNONGPDUPE-UHFFFAOYSA-N
SMILES:
SC1CCOC2(C1)CCC2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.077g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.259g/mol
Monoisotopic Mass:
158.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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