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Home > Nitro Compounds > 87997-43-1
87997-43-1 | 7H-Furo[3,2-g][1]benzopyran-7-one, 4-methoxy-9-nitro-
CAS No: 87997-43-1 Catalog No: AG004KO5 MDL No:
Product Description
Catalog Number:
AG004KO5
Chemical Name:
7H-Furo[3,2-g][1]benzopyran-7-one, 4-methoxy-9-nitro-
CAS Number:
87997-43-1
Molecular Formula:
C12H7NO6
Molecular Weight:
261.1871
IUPAC Name:
4-methoxy-9-nitrofuro[3,2-g]chromen-7-one
InChI:
InChI=1S/C12H7NO6/c1-17-10-6-2-3-8(14)19-12(6)9(13(15)16)11-7(10)4-5-18-11/h2-5H,1H3
InChI Key:
QXCHVGQTFZHJQC-UHFFFAOYSA-N
SMILES:
COc1c2ccc(=O)oc2c(c2c1cco2)[N+](=O)[O-]
Properties
Complexity:
430
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.027g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.189g/mol
Monoisotopic Mass:
261.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
94.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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