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55094-52-5 | (3R,4R,5R)-3,4-Bis(benzyloxy)-5-((benzyloxy)methyl)dihydrofuran-2(3H)-one
CAS No: 55094-52-5 Catalog No: AG0038O2 MDL No:MFCD08703966
Product Description
Catalog Number:
AG0038O2
Chemical Name:
(3R,4R,5R)-3,4-Bis(benzyloxy)-5-((benzyloxy)methyl)dihydrofuran-2(3H)-one
CAS Number:
55094-52-5
Molecular Formula:
C26H26O5
Molecular Weight:
418.4816
MDL Number:
MFCD08703966
IUPAC Name:
(3R,4R,5R)-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-one
InChI:
InChI=1S/C26H26O5/c27-26-25(30-18-22-14-8-3-9-15-22)24(29-17-21-12-6-2-7-13-21)23(31-26)19-28-16-20-10-4-1-5-11-20/h1-15,23-25H,16-19H2/t23-,24-,25-/m1/s1
InChI Key:
LDHBSABBBAUMCZ-UBFVSLLYSA-N
SMILES:
O=C1O[C@@H]([C@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1
Properties
Complexity:
520
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
418.178g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
418.489g/mol
Monoisotopic Mass:
418.178g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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