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89215-14-5 | 7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2-oxopropyl)-
CAS No: 89215-14-5 Catalog No: AG0043TH MDL No:
Product Description
Catalog Number:
AG0043TH
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 9-(2-oxopropyl)-
CAS Number:
89215-14-5
Molecular Formula:
C14H10O4
Molecular Weight:
242.2268
IUPAC Name:
9-(2-oxopropyl)furo[3,2-g]chromen-7-one
InChI:
InChI=1S/C14H10O4/c1-8(15)6-11-13-10(4-5-17-13)7-9-2-3-12(16)18-14(9)11/h2-5,7H,6H2,1H3
InChI Key:
QSVMNBCWAWEFJX-UHFFFAOYSA-N
SMILES:
CC(=O)Cc1c2oc(=O)ccc2cc2c1occ2
Properties
Complexity:
401
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:
2
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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