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151598-47-9 | 7H-Furo[3,2-g][1]benzopyran-7-one, 3-(iodomethyl)-2,5,9-trimethyl-
CAS No: 151598-47-9 Catalog No: AG001NFF MDL No:
Product Description
Catalog Number:
AG001NFF
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 3-(iodomethyl)-2,5,9-trimethyl-
CAS Number:
151598-47-9
Molecular Formula:
C15H13IO3
Molecular Weight:
368.1664
IUPAC Name:
3-(iodomethyl)-2,5,9-trimethylfuro[3,2-g]chromen-7-one
InChI:
InChI=1S/C15H13IO3/c1-7-4-13(17)19-14-8(2)15-11(5-10(7)14)12(6-16)9(3)18-15/h4-5H,6H2,1-3H3
InChI Key:
LLXYKTSYKUCHCN-UHFFFAOYSA-N
SMILES:
ICc1c(C)oc2c1cc1c(C)cc(=O)oc1c2C
Properties
Complexity:
420
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.991g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.17g/mol
Monoisotopic Mass:
367.991g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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