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Home > Nitro Compounds > 7369-50-8
7369-50-8 | Benzene,1-ethyl-3-nitro-
CAS No: 7369-50-8 Catalog No: AG005LSZ MDL No:MFCD00130058
Product Description
Catalog Number:
AG005LSZ
Chemical Name:
Benzene,1-ethyl-3-nitro-
CAS Number:
7369-50-8
Molecular Formula:
C8H9NO2
Molecular Weight:
151.1626
MDL Number:
MFCD00130058
IUPAC Name:
1-ethyl-3-nitrobenzene
InChI:
InChI=1S/C8H9NO2/c1-2-7-4-3-5-8(6-7)9(10)11/h3-6H,2H2,1H3
InChI Key:
RXAKLPGKSXJZEF-UHFFFAOYSA-N
SMILES:
CCc1cccc(c1)[N+](=O)[O-]
EC Number:
230-923-6
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.063g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.165g/mol
Monoisotopic Mass:
151.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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