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65475-47-0 | 2,4,6-Trioxabicyclo[3.2.0]heptan-3-one, 7,7-bis[(acetyloxy)methyl]-
CAS No: 65475-47-0 Catalog No: AG006Q5F MDL No:
Product Description
Catalog Number:
AG006Q5F
Chemical Name:
2,4,6-Trioxabicyclo[3.2.0]heptan-3-one, 7,7-bis[(acetyloxy)methyl]-
CAS Number:
65475-47-0
Molecular Formula:
C10H12O8
Molecular Weight:
260.1975
IUPAC Name:
[7-(acetyloxymethyl)-3-oxo-2,4,6-trioxabicyclo[3.2.0]heptan-7-yl]methyl acetate
InChI:
InChI=1S/C10H12O8/c1-5(11)14-3-10(4-15-6(2)12)7-8(18-10)17-9(13)16-7/h7-8H,3-4H2,1-2H3
InChI Key:
QNKQHICUEAOEHA-UHFFFAOYSA-N
SMILES:
CC(=O)OCC1(COC(=O)C)OC2C1OC(=O)O2
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.198g/mol
Monoisotopic Mass:
260.053g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
97.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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