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1594-46-3 | 9,10-Anthracenedione, 1,2-dichloro-
CAS No: 1594-46-3 Catalog No: AG001QOE MDL No:
Product Description
Catalog Number:
AG001QOE
Chemical Name:
9,10-Anthracenedione, 1,2-dichloro-
CAS Number:
1594-46-3
Molecular Formula:
C14H6Cl2O2
Molecular Weight:
277.1022
IUPAC Name:
1,2-dichloroanthracene-9,10-dione
InChI:
InChI=1S/C14H6Cl2O2/c15-10-6-5-9-11(12(10)16)14(18)8-4-2-1-3-7(8)13(9)17/h1-6H
InChI Key:
PLUFITIFLBGFPN-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=O)c2c1ccc(c2Cl)Cl
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.974g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.1g/mol
Monoisotopic Mass:
275.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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