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114460-34-3 | 7H-Furo[3,2-g][1]benzopyran-7-one, 2-acetyl-9-methyl-
CAS No: 114460-34-3 Catalog No: AG000EG7 MDL No:
Product Description
Catalog Number:
AG000EG7
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 2-acetyl-9-methyl-
CAS Number:
114460-34-3
Molecular Formula:
C14H10O4
Molecular Weight:
242.2268
IUPAC Name:
2-acetyl-9-methylfuro[3,2-g]chromen-7-one
InChI:
InChI=1S/C14H10O4/c1-7-13-9(3-4-12(16)18-13)5-10-6-11(8(2)15)17-14(7)10/h3-6H,1-2H3
InChI Key:
UBAQOMNVOJXBKF-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)c(C)c1c(c2)cc(o1)C(=O)C
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.058g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.23g/mol
Monoisotopic Mass:
242.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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