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66041-61-0 | 4,4'-Dihydroxy-3,3'-dinitrobiphenyl
CAS No: 66041-61-0 Catalog No: AG00FOWL MDL No:
Product Description
Catalog Number:
AG00FOWL
Chemical Name:
4,4'-Dihydroxy-3,3'-dinitrobiphenyl
CAS Number:
66041-61-0
IUPAC Name:
4-(4-hydroxy-3-nitrophenyl)-2-nitrophenol
InChI:
InChI=1S/C12H8N2O6/c15-11-3-1-7(5-9(11)13(17)18)8-2-4-12(16)10(6-8)14(19)20/h1-6,15-16H
InChI Key:
NTXCSKZBHUKPQU-UHFFFAOYSA-N
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.038g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
276.204g/mol
Monoisotopic Mass:
276.038g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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