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Acetic acid 5'-acetoxy-2,2'-diphenyl-(4,4')bi((1,3)dioxanyl)-5-yl ester

HCID 219725
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Basic information

CAS
5334-18-9
Standard SMILES
CC(=O)OC1COC(c2ccccc2)OC1C1OC(c2ccccc2)OCC1OC(C)=O
InChIKey
POIACHWXRFNXHC-UHFFFAOYSA-N
Molecular formula
C24H26O8
Average molar mass
442.5 g/mol
Monoisotopic mass
442.16276778

Names & identifiers

Preferred name
Acetic acid 5'-acetoxy-2,2'-diphenyl-(4,4')bi((1,3)dioxanyl)-5-yl ester
IUPAC
[4-(5-acetyloxy-2-phenyl-1,3-dioxan-4-yl)-2-phenyl-1,3-dioxan-5-yl] acetate

Names & synonyms

NSC1386NSC 13865334-18-9Acetic acid 5'-acetoxy-2,2'-diphenyl-(4,4')bi((1,3)dioxanyl)-5-yl esterAcetic acid 5'-acetoxy-2,2'-diphenyl-[4,4']bi[[1,3]dioxanyl]-5-yl esterNSC-1386MESO-1,6-DI-O-BENZYLIDENEGALACTITOL, DIACETATE[4-(5-acetoxy-2-phenyl-1,3-dioxan-4-yl)-2-phenyl-1,3-dioxan-5-yl] acetate

Database identifiers

CAS
5334-18-9
PubChem CID
219725

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
89.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
7
Heavy atoms
32
Formal charge
0
Complexity
573

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