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138760-36-8 | 1,3-Oxathiolan-5-one, 2-(hydroxymethyl)-
CAS No: 138760-36-8 Catalog No: AG0019HS MDL No:
Product Description
Catalog Number:
AG0019HS
Chemical Name:
1,3-Oxathiolan-5-one, 2-(hydroxymethyl)-
CAS Number:
138760-36-8
Molecular Formula:
C4H6O3S
Molecular Weight:
134.1536
IUPAC Name:
2-(hydroxymethyl)-1,3-oxathiolan-5-one
InChI:
InChI=1S/C4H6O3S/c5-1-4-7-3(6)2-8-4/h4-5H,1-2H2
InChI Key:
RRHCTVYNFRNAOZ-UHFFFAOYSA-N
SMILES:
OCC1OC(=O)CS1
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.004g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.149g/mol
Monoisotopic Mass:
134.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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