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129-38-4 | 9,10-Anthracenedione, 1-chloro-8-nitro-
CAS No: 129-38-4 Catalog No: AG000YRJ MDL No:
Product Description
Catalog Number:
AG000YRJ
Chemical Name:
9,10-Anthracenedione, 1-chloro-8-nitro-
CAS Number:
129-38-4
Molecular Formula:
C14H6ClNO4
Molecular Weight:
287.6547
IUPAC Name:
1-chloro-8-nitroanthracene-9,10-dione
InChI:
InChI=1S/C14H6ClNO4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16(19)20/h1-6H
InChI Key:
DPXBPDAJRIKYIA-UHFFFAOYSA-N
SMILES:
O=C1c2cccc(c2C(=O)c2c1cccc2[N+](=O)[O-])Cl
NSC Number:
15365
Properties
Complexity:
461
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.999g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.655g/mol
Monoisotopic Mass:
286.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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