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918300-47-7 | 2H-Naphtho[2,3-b]pyran-2-one, 5-bromo-10-hydroxy-
CAS No: 918300-47-7 Catalog No: AG006GI6 MDL No:
Product Description
Catalog Number:
AG006GI6
Chemical Name:
2H-Naphtho[2,3-b]pyran-2-one, 5-bromo-10-hydroxy-
CAS Number:
918300-47-7
Molecular Formula:
C13H7BrO3
Molecular Weight:
291.0969
IUPAC Name:
5-bromo-10-hydroxybenzo[g]chromen-2-one
InChI:
InChI=1S/C13H7BrO3/c14-11-7-3-1-2-4-8(7)12(16)13-9(11)5-6-10(15)17-13/h1-6,16H
InChI Key:
ITHDNMCWRIWUPU-UHFFFAOYSA-N
SMILES:
O=c1ccc2c(o1)c(O)c1c(c2Br)cccc1
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.958g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.1g/mol
Monoisotopic Mass:
289.958g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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