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Home > Nitro Compounds > 99766-46-8
99766-46-8 | 1-ethyl-3-methyl-2-nitroso-benzene
CAS No: 99766-46-8 Catalog No: AG004X87 MDL No:
Product Description
Catalog Number:
AG004X87
Chemical Name:
1-ethyl-3-methyl-2-nitroso-benzene
CAS Number:
99766-46-8
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
IUPAC Name:
1-ethyl-3-methyl-2-nitrosobenzene
InChI:
InChI=1S/C9H11NO/c1-3-8-6-4-5-7(2)9(8)10-11/h4-6H,3H2,1-2H3
InChI Key:
JOMISUGPCBFHEU-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1N=O)C
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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