Benzene-d5, nitro-


Chemical Name: Benzene-d5, nitro-
CAS Number: 4165-60-0
Product Number: AG00BY8J(AGN-PC-0RQVP9)
Synonyms:
MDL No:
Molecular Formula: C6D5NO2
Molecular Weight: 128.1402

Identification/Properties


Computed Properties
Molecular Weight:
128.142g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
128.063g/mol
Monoisotopic Mass:
128.063g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
102
Isotope Atom Count:
5
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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