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Home > Nitro Compounds > 173846-18-9
173846-18-9 | Dibenzofuran, 2-(2-methyl-1,3-dioxolan-2-yl)-7-nitro-
CAS No: 173846-18-9 Catalog No: AG001Z86 MDL No:
Product Description
Catalog Number:
AG001Z86
Chemical Name:
Dibenzofuran, 2-(2-methyl-1,3-dioxolan-2-yl)-7-nitro-
CAS Number:
173846-18-9
Molecular Formula:
C16H13NO5
Molecular Weight:
299.2781
IUPAC Name:
2-(2-methyl-1,3-dioxolan-2-yl)-7-nitrodibenzofuran
InChI:
InChI=1S/C16H13NO5/c1-16(20-6-7-21-16)10-2-5-14-13(8-10)12-4-3-11(17(18)19)9-15(12)22-14/h2-5,8-9H,6-7H2,1H3
InChI Key:
AVSDAULMDPYNFZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)oc1c2cc(cc1)C1(C)OCCO1
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.079g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.282g/mol
Monoisotopic Mass:
299.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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