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234076-75-6 | Anthracene, 2,9-dinitro-
CAS No: 234076-75-6 Catalog No: AG002N4G MDL No:
Product Description
Catalog Number:
AG002N4G
Chemical Name:
Anthracene, 2,9-dinitro-
CAS Number:
234076-75-6
Molecular Formula:
C14H8N2O4
Molecular Weight:
268.2243
IUPAC Name:
2,9-dinitroanthracene
InChI:
InChI=1S/C14H8N2O4/c17-15(18)11-6-5-10-7-9-3-1-2-4-12(9)14(16(19)20)13(10)8-11/h1-8H
InChI Key:
KZKKCRIBUXLWCS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c2cc(ccc2cc2c1cccc2)[N+](=O)[O-]
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.048g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.228g/mol
Monoisotopic Mass:
268.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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