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128650-15-7

128650-15-7 | 5H-[2]Benzopyrano[3,4-g][1,4]benzodioxin-5-one, 9,10-dihydro-

CAS No: 128650-15-7 Catalog No: AG000Y9K MDL No:

Product Description

Catalog Number:
AG000Y9K
Chemical Name:
5H-[2]Benzopyrano[3,4-g][1,4]benzodioxin-5-one, 9,10-dihydro-
CAS Number:
128650-15-7
Molecular Formula:
C15H10O4
Molecular Weight:
254.2375
IUPAC Name:
9,10-dihydroisochromeno[3,4-g][1,4]benzodioxin-5-one
InChI:
InChI=1S/C15H10O4/c16-15-10-4-2-1-3-9(10)11-7-13-14(8-12(11)19-15)18-6-5-17-13/h1-4,7-8H,5-6H2
InChI Key:
DOQCNNMRRCKQBC-UHFFFAOYSA-N
SMILES:
O=c1oc2cc3OCCOc3cc2c2c1cccc2

Properties

Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.058g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.241g/mol
Monoisotopic Mass:
254.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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