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10183-94-5 | 1(2H)-Anthracenone, 3,4-dihydro-8,9-dihydroxy-
CAS No: 10183-94-5 Catalog No: AG0005NR MDL No:
Product Description
Catalog Number:
AG0005NR
Chemical Name:
1(2H)-Anthracenone, 3,4-dihydro-8,9-dihydroxy-
CAS Number:
10183-94-5
Molecular Formula:
C14H12O3
Molecular Weight:
228.2433
IUPAC Name:
8,9-dihydroxy-3,4-dihydro-2H-anthracen-1-one
InChI:
InChI=1S/C14H12O3/c15-10-5-1-3-8-7-9-4-2-6-11(16)13(9)14(17)12(8)10/h1,3,5,7,15,17H,2,4,6H2
InChI Key:
IFADZYPDPVTFAT-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1c(O)c1c(c2)cccc1O
UNII:
66MY92IL8I
NSC Number:
71802
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.247g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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