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148430-81-3 | 3-Oxetanol, 3-methanesulfonate
CAS No: 148430-81-3 Catalog No: AG001KX2 MDL No:MFCD22192544
Product Description
Catalog Number:
AG001KX2
Chemical Name:
3-Oxetanol, 3-methanesulfonate
CAS Number:
148430-81-3
Molecular Formula:
C4H8O4S
Molecular Weight:
152.1689
MDL Number:
MFCD22192544
IUPAC Name:
oxetan-3-yl methanesulfonate
InChI:
InChI=1S/C4H8O4S/c1-9(5,6)8-4-2-7-3-4/h4H,2-3H2,1H3
InChI Key:
ZLYYZGDBMXPXOA-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)OC1COC1
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.164g/mol
Monoisotopic Mass:
152.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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