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Home > Nitro Compounds > 71466-56-3
71466-56-3 | 1-(3,4-Dinitrophenyl)tricyclo[3.3.1.13,7]decane
CAS No: 71466-56-3 Catalog No: AG00FPPR MDL No:
Product Description
Catalog Number:
AG00FPPR
Chemical Name:
1-(3,4-Dinitrophenyl)tricyclo[3.3.1.13,7]decane
CAS Number:
71466-56-3
IUPAC Name:
1-(3,4-dinitrophenyl)adamantane
InChI:
InChI=1S/C16H18N2O4/c19-17(20)14-2-1-13(6-15(14)18(21)22)16-7-10-3-11(8-16)5-12(4-10)9-16/h1-2,6,10-12H,3-5,7-9H2
InChI Key:
BXLUNPNZYFVOSL-UHFFFAOYSA-N
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.127g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.33g/mol
Monoisotopic Mass:
302.127g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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