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Home > Nitro Compounds > 75965-79-6
75965-79-6 | 8-Methoxy-2-nitronaphtho(2,3-b)furan
CAS No: 75965-79-6 Catalog No: AG005961 MDL No:
Product Description
Catalog Number:
AG005961
Chemical Name:
8-Methoxy-2-nitronaphtho(2,3-b)furan
CAS Number:
75965-79-6
Molecular Formula:
C13H9NO4
Molecular Weight:
243.2149
IUPAC Name:
8-methoxy-2-nitrobenzo[f][1]benzofuran
InChI:
InChI=1S/C13H9NO4/c1-17-11-4-2-3-8-5-9-6-13(14(15)16)18-12(9)7-10(8)11/h2-7H,1H3
InChI Key:
VBVIYUGENXSHQJ-UHFFFAOYSA-N
SMILES:
COc1cccc2c1cc1oc(cc1c2)[N+](=O)[O-]
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.053g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.218g/mol
Monoisotopic Mass:
243.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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