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Home > Nitro Compounds > 1451450-77-3
1451450-77-3 | 2-(4-Nitrophenyl)cyclooctan-1-one
CAS No: 1451450-77-3 Catalog No: AG00HXEB MDL No:
Product Description
Catalog Number:
AG00HXEB
Chemical Name:
2-(4-Nitrophenyl)cyclooctan-1-one
CAS Number:
1451450-77-3
IUPAC Name:
2-(4-nitrophenyl)cyclooctan-1-one
InChI:
InChI=1S/C14H17NO3/c16-14-6-4-2-1-3-5-13(14)11-7-9-12(10-8-11)15(17)18/h7-10,13H,1-6H2
InChI Key:
WEGWGUHUQAPRJN-UHFFFAOYSA-N
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.294g/mol
Monoisotopic Mass:
247.121g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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