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235097-76-4 | Ethanol, 2-(1-methylethoxy)-, 1-methanesulfonate
CAS No: 235097-76-4 Catalog No: AG002NGI MDL No:MFCD02093478
Product Description
Catalog Number:
AG002NGI
Chemical Name:
Ethanol, 2-(1-methylethoxy)-, 1-methanesulfonate
CAS Number:
235097-76-4
Molecular Formula:
C6H14O4S
Molecular Weight:
182.2380
MDL Number:
MFCD02093478
IUPAC Name:
2-propan-2-yloxyethyl methanesulfonate
InChI:
InChI=1S/C6H14O4S/c1-6(2)9-4-5-10-11(3,7)8/h6H,4-5H2,1-3H3
InChI Key:
YDKQNGZSQDGFRB-UHFFFAOYSA-N
SMILES:
CC(OCCOS(=O)(=O)C)C
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.061g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.234g/mol
Monoisotopic Mass:
182.061g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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