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Home > Other Heterocycles > 67965-10-0
67965-10-0 | 8-ethoxy-8-methyl-3-(trityloxymethyl)-2,7,9-trioxabicyclo[4.3.0]nonane-4,5-diol
CAS No: 67965-10-0 Catalog No: AG0061NX MDL No:
Product Description
Catalog Number:
AG0061NX
Chemical Name:
8-ethoxy-8-methyl-3-(trityloxymethyl)-2,7,9-trioxabicyclo[4.3.0]nonane-4,5-diol
CAS Number:
67965-10-0
Molecular Formula:
C29H32O7
Molecular Weight:
492.5602
IUPAC Name:
2-ethoxy-2-methyl-5-(trityloxymethyl)-5,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-b]pyran-6,7-diol
InChI:
InChI=1S/C29H32O7/c1-3-32-28(2)35-26-25(31)24(30)23(34-27(26)36-28)19-33-29(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-18,23-27,30-31H,3,19H2,1-2H3
InChI Key:
ROLYREVEODSZNZ-UHFFFAOYSA-N
SMILES:
CCOC1(C)OC2C(O1)OC(C(C2O)O)COC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
640
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
492.215g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
492.568g/mol
Monoisotopic Mass:
492.215g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
6
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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