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77573-56-9 | Ethanol, 1,1'-dioxybis-
CAS No: 77573-56-9 Catalog No: AG005GPL MDL No:
Product Description
Catalog Number:
AG005GPL
Chemical Name:
Ethanol, 1,1'-dioxybis-
CAS Number:
77573-56-9
Molecular Formula:
C4H10O4
Molecular Weight:
122.1198
IUPAC Name:
1-(1-hydroxyethylperoxy)ethanol
InChI:
InChI=1S/C4H10O4/c1-3(5)7-8-4(2)6/h3-6H,1-2H3
InChI Key:
MHXULVADFCJJOZ-UHFFFAOYSA-N
SMILES:
CC(OOC(O)C)O
Properties
Complexity:
48
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.058g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
122.12g/mol
Monoisotopic Mass:
122.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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