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Home > Nitro Compounds > 6665-97-0
6665-97-0 | 2,6-Dimethoxynitrobenzene 98%
CAS No: 6665-97-0 Catalog No: AG00FBJU MDL No:MFCD00474587
Product Description
Catalog Number:
AG00FBJU
Chemical Name:
2,6-Dimethoxynitrobenzene 98%
CAS Number:
6665-97-0
Molecular Formula:
C8H9NO4
Molecular Weight:
183.1614
MDL Number:
MFCD00474587
IUPAC Name:
1,3-dimethoxy-2-nitrobenzene
InChI:
InChI=1S/C8H9NO4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3
InChI Key:
MVBXGGHFJZBKFJ-UHFFFAOYSA-N
SMILES:
COc1cccc(c1[N+](=O)[O-])OC
NSC Number:
291284
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.163g/mol
Monoisotopic Mass:
183.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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