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28664-60-0 | 7H-Furo[3,2-g][1]benzopyran-7-one, 2-(1-hydroxy-1-methylethyl)-
CAS No: 28664-60-0 Catalog No: AG002W0B MDL No:
Product Description
Catalog Number:
AG002W0B
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 2-(1-hydroxy-1-methylethyl)-
CAS Number:
28664-60-0
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
IUPAC Name:
2-(2-hydroxypropan-2-yl)furo[3,2-g]chromen-7-one
InChI:
InChI=1S/C14H12O4/c1-14(2,16)12-6-9-5-8-3-4-13(15)18-10(8)7-11(9)17-12/h3-7,16H,1-2H3
InChI Key:
QITAPBJXOHCHQR-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)cc1c(c2)cc(o1)C(O)(C)C
Properties
Complexity:
387
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.246g/mol
Monoisotopic Mass:
244.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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