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14789-48-1 | Anthracene, 9-bromo-10-nitro-
CAS No: 14789-48-1 Catalog No: AG001F9C MDL No:
Product Description
Catalog Number:
AG001F9C
Chemical Name:
Anthracene, 9-bromo-10-nitro-
CAS Number:
14789-48-1
Molecular Formula:
C14H8BrNO2
Molecular Weight:
302.1228
IUPAC Name:
9-bromo-10-nitroanthracene
InChI:
InChI=1S/C14H8BrNO2/c15-13-9-5-1-3-7-11(9)14(16(17)18)12-8-4-2-6-10(12)13/h1-8H
InChI Key:
GPJVNZGKVVMVHA-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c2ccccc2c(c2c1cccc2)Br
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.974g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.127g/mol
Monoisotopic Mass:
300.974g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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