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Home > Nitro Compounds > 89228-66-0
89228-66-0 | Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-
CAS No: 89228-66-0 Catalog No: AG0042YR MDL No:MFCD05256202
Product Description
Catalog Number:
AG0042YR
Chemical Name:
Benzene, 1-methoxy-4-nitro-2-(2-propynyloxy)-
CAS Number:
89228-66-0
Molecular Formula:
C10H9NO4
Molecular Weight:
207.1828
MDL Number:
MFCD05256202
IUPAC Name:
1-methoxy-4-nitro-2-prop-2-ynoxybenzene
InChI:
InChI=1S/C10H9NO4/c1-3-6-15-10-7-8(11(12)13)4-5-9(10)14-2/h1,4-5,7H,6H2,2H3
InChI Key:
NOQXZRFEQHNLDE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(OCC#C)c(cc1)OC
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.053g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.185g/mol
Monoisotopic Mass:
207.053g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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