Benzoic-2,3,4,5-d4 acid, 6-hydroxy-


Chemical Name: Benzoic-2,3,4,5-d4 acid, 6-hydroxy-
CAS Number: 78646-17-0
Product Number: AG008M7W(AGN-PC-0UDNQD)
Synonyms:
MDL No:
Molecular Formula: C7H2D4O3
Molecular Weight: 142.1454

Identification/Properties


Computed Properties
Molecular Weight:
142.146g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
142.057g/mol
Monoisotopic Mass:
142.057g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
133
Isotope Atom Count:
4
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

Safety Information


NMR Spectrum


Other Analytical Data


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