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114415-01-9 | Methanone, (2,3-dihydroxyphenyl)(3,4,5-trihydroxyphenyl)-
CAS No: 114415-01-9 Catalog No: AG000BAO MDL No:
Product Description
Catalog Number:
AG000BAO
Chemical Name:
Methanone, (2,3-dihydroxyphenyl)(3,4,5-trihydroxyphenyl)-
CAS Number:
114415-01-9
Molecular Formula:
C13H10O6
Molecular Weight:
262.2149
IUPAC Name:
(2,3-dihydroxyphenyl)-(3,4,5-trihydroxyphenyl)methanone
InChI:
InChI=1S/C13H10O6/c14-8-3-1-2-7(12(8)18)11(17)6-4-9(15)13(19)10(16)5-6/h1-5,14-16,18-19H
InChI Key:
LMZNOSFQBKBMNN-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1O)O)c1cc(O)c(c(c1)O)O
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.048g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
262.217g/mol
Monoisotopic Mass:
262.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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