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Home > Nitro Compounds > 198829-77-5
198829-77-5 | Benzene, 1-[(2-methoxyethoxy)methoxy]-4-nitro-
CAS No: 198829-77-5 Catalog No: AG002BR9 MDL No:
Product Description
Catalog Number:
AG002BR9
Chemical Name:
Benzene, 1-[(2-methoxyethoxy)methoxy]-4-nitro-
CAS Number:
198829-77-5
Molecular Formula:
C10H13NO5
Molecular Weight:
227.2139
IUPAC Name:
1-(2-methoxyethoxymethoxy)-4-nitrobenzene
InChI:
InChI=1S/C10H13NO5/c1-14-6-7-15-8-16-10-4-2-9(3-5-10)11(12)13/h2-5H,6-8H2,1H3
InChI Key:
BVHIHGIVJOLZME-UHFFFAOYSA-N
SMILES:
COCCOCOc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.079g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.216g/mol
Monoisotopic Mass:
227.079g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
73.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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