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Home > Nitro Compounds > 71466-53-0
71466-53-0 | 1-(3,5-Dinitrophenyl)tricyclo[3.3.1.13,7]decane
CAS No: 71466-53-0 Catalog No: AG00FPPW MDL No:
Product Description
Catalog Number:
AG00FPPW
Chemical Name:
1-(3,5-Dinitrophenyl)tricyclo[3.3.1.13,7]decane
CAS Number:
71466-53-0
IUPAC Name:
1-(3,5-dinitrophenyl)adamantane
InChI:
InChI=1S/C16H18N2O4/c19-17(20)14-4-13(5-15(6-14)18(21)22)16-7-10-1-11(8-16)3-12(2-10)9-16/h4-6,10-12H,1-3,7-9H2
InChI Key:
ZJHAOJFMSRDDQQ-UHFFFAOYSA-N
Properties
Complexity:
432
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
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