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114662-64-5 | 2,2'-Bi-1,4-benzodioxin, 2,2',3,3'-tetrahydro-
CAS No: 114662-64-5 Catalog No: AG000EZL MDL No:
Product Description
Catalog Number:
AG000EZL
Chemical Name:
2,2'-Bi-1,4-benzodioxin, 2,2',3,3'-tetrahydro-
CAS Number:
114662-64-5
Molecular Formula:
C16H14O4
Molecular Weight:
270.2800
IUPAC Name:
3-(2,3-dihydro-1,4-benzodioxin-3-yl)-2,3-dihydro-1,4-benzodioxine
InChI:
InChI=1S/C16H14O4/c1-3-7-13-11(5-1)17-9-15(19-13)16-10-18-12-6-2-4-8-14(12)20-16/h1-8,15-16H,9-10H2
InChI Key:
DICBFZVRRORZGW-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)OC(CO2)C1COc2c(O1)cccc2
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.089g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.284g/mol
Monoisotopic Mass:
270.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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