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14159-13-8 | 7H-Furo[3,2-g][1]benzopyran-7-one, 5-methyl-
CAS No: 14159-13-8 Catalog No: AG001GN7 MDL No:
Product Description
Catalog Number:
AG001GN7
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 5-methyl-
CAS Number:
14159-13-8
Molecular Formula:
C12H8O3
Molecular Weight:
200.1901
IUPAC Name:
5-methylfuro[3,2-g]chromen-7-one
InChI:
InChI=1S/C12H8O3/c1-7-4-12(13)15-11-6-10-8(2-3-14-10)5-9(7)11/h2-6H,1H3
InChI Key:
TUTMEHZVWWQNMW-UHFFFAOYSA-N
SMILES:
O=c1cc(C)c2c(o1)cc1c(c2)cco1
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.047g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.193g/mol
Monoisotopic Mass:
200.047g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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