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Home > Other Heterocycles > 89729-09-9

89729-09-9

89729-09-9 | 5,7-Dioxa-6-thiaspiro[2.5]octane 6-oxide

CAS No: 89729-09-9 Catalog No: AG004296 MDL No:MFCD09832878

Product Description

Catalog Number:
AG004296
Chemical Name:
5,7-Dioxa-6-thiaspiro[2.5]octane 6-oxide
CAS Number:
89729-09-9
Molecular Formula:
C5H8O3S
Molecular Weight:
148.1802
MDL Number:
MFCD09832878
IUPAC Name:
5,7-dioxa-6λ4-thiaspiro[2.5]octane 6-oxide
InChI:
InChI=1S/C5H8O3S/c6-9-7-3-5(1-2-5)4-8-9/h1-4H2
InChI Key:
AISMUYPWEMPRTF-UHFFFAOYSA-N
SMILES:
O=S1OCC2(CO1)CC2

Properties

Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.019g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.176g/mol
Monoisotopic Mass:
148.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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