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Home > Other Heterocycles > 923026-60-2
923026-60-2 | 3-Oxabicyclo[4.2.0]oct-7-en-5-one, 1-methoxy-7,8-diphenyl-
CAS No: 923026-60-2 Catalog No: AG0068MH MDL No:
Product Description
Catalog Number:
AG0068MH
Chemical Name:
3-Oxabicyclo[4.2.0]oct-7-en-5-one, 1-methoxy-7,8-diphenyl-
CAS Number:
923026-60-2
Molecular Formula:
C20H18O3
Molecular Weight:
306.3551
IUPAC Name:
1-methoxy-7,8-diphenyl-3-oxabicyclo[4.2.0]oct-7-en-5-one
InChI:
InChI=1S/C20H18O3/c1-22-20-13-23-12-16(21)19(20)17(14-8-4-2-5-9-14)18(20)15-10-6-3-7-11-15/h2-11,19H,12-13H2,1H3
InChI Key:
CXTHNDHRDZDEOA-UHFFFAOYSA-N
SMILES:
COC12COCC(=O)C1C(=C2c1ccccc1)c1ccccc1
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.126g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.361g/mol
Monoisotopic Mass:
306.126g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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