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86357-13-3 | 1,3-Diacetoxy-2-(Acetoxymethoxy)Propane
CAS No: 86357-13-3 Catalog No: AG0032LF MDL No:MFCD08457701
Product Description
Catalog Number:
AG0032LF
Chemical Name:
1,3-Diacetoxy-2-(Acetoxymethoxy)Propane
CAS Number:
86357-13-3
Molecular Formula:
C10H16O7
Molecular Weight:
248.2298
MDL Number:
MFCD08457701
IUPAC Name:
[3-acetyloxy-2-(acetyloxymethoxy)propyl] acetate
InChI:
InChI=1S/C10H16O7/c1-7(11)14-4-10(5-15-8(2)12)17-6-16-9(3)13/h10H,4-6H2,1-3H3
InChI Key:
DUOPMEBLLUYTNT-UHFFFAOYSA-N
SMILES:
CC(=O)OCOC(COC(=O)C)COC(=O)C
EC Number:
617-837-8
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.231g/mol
Monoisotopic Mass:
248.09g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
88.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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