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18103-21-4 | 2H-1-Benzopyran-2-one, 4-methyl-5,7-bis(2-propen-1-yloxy)-
CAS No: 18103-21-4 Catalog No: AG0022MG MDL No:
Product Description
Catalog Number:
AG0022MG
Chemical Name:
2H-1-Benzopyran-2-one, 4-methyl-5,7-bis(2-propen-1-yloxy)-
CAS Number:
18103-21-4
Molecular Formula:
C16H16O4
Molecular Weight:
272.2958
IUPAC Name:
4-methyl-5,7-bis(prop-2-enoxy)chromen-2-one
InChI:
InChI=1S/C16H16O4/c1-4-6-18-12-9-13(19-7-5-2)16-11(3)8-15(17)20-14(16)10-12/h4-5,8-10H,1-2,6-7H2,3H3
InChI Key:
SFENFSWNRGDHEO-UHFFFAOYSA-N
SMILES:
C=CCOc1cc(OCC=C)c2c(c1)oc(=O)cc2C
Properties
Complexity:
413
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.3g/mol
Monoisotopic Mass:
272.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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