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Home > Nitro Compounds > 2060062-93-1
2060062-93-1 | 5-methoxy-3-nitro-1-benzofuran
CAS No: 2060062-93-1 Catalog No: AG01BOPN MDL No:MFCD30499423
Product Description
Catalog Number:
AG01BOPN
Chemical Name:
5-methoxy-3-nitro-1-benzofuran
CAS Number:
2060062-93-1
Molecular Formula:
C9H7NO4
Molecular Weight:
193.1562
MDL Number:
MFCD30499423
IUPAC Name:
5-methoxy-3-nitro-1-benzofuran
InChI:
InChI=1S/C9H7NO4/c1-13-6-2-3-9-7(4-6)8(5-14-9)10(11)12/h2-5H,1H3
InChI Key:
LUVOPVKGCRMBCV-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(co2)[N+](=O)[O-]
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.158g/mol
Monoisotopic Mass:
193.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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