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Home > Other Heterocycles > 6752-49-4
6752-49-4 | 9-methoxy-4-phenyl-3,5,10-trioxabicyclo[4.4.0]decan-7-one
CAS No: 6752-49-4 Catalog No: AG005MV0 MDL No:
Product Description
Catalog Number:
AG005MV0
Chemical Name:
9-methoxy-4-phenyl-3,5,10-trioxabicyclo[4.4.0]decan-7-one
CAS Number:
6752-49-4
Molecular Formula:
C14H16O5
Molecular Weight:
264.2738
IUPAC Name:
6-methoxy-2-phenyl-4a,6,7,8a-tetrahydro-4H-pyrano[3,2-d][1,3]dioxin-8-one
InChI:
InChI=1S/C14H16O5/c1-16-12-7-10(15)13-11(18-12)8-17-14(19-13)9-5-3-2-4-6-9/h2-6,11-14H,7-8H2,1H3
InChI Key:
UUNOJMADDVNEMA-UHFFFAOYSA-N
SMILES:
COC1CC(=O)C2C(O1)COC(O2)c1ccccc1
NSC Number:
266495
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.277g/mol
Monoisotopic Mass:
264.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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