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Home > Nitro Compounds > 190448-47-6
190448-47-6 | 1,3-Dioxolane, 2-(4-nitrophenyl)-2-phenyl-
CAS No: 190448-47-6 Catalog No: AG002EKZ MDL No:
Product Description
Catalog Number:
AG002EKZ
Chemical Name:
1,3-Dioxolane, 2-(4-nitrophenyl)-2-phenyl-
CAS Number:
190448-47-6
Molecular Formula:
C15H13NO4
Molecular Weight:
271.2680
IUPAC Name:
2-(4-nitrophenyl)-2-phenyl-1,3-dioxolane
InChI:
InChI=1S/C15H13NO4/c17-16(18)14-8-6-13(7-9-14)15(19-10-11-20-15)12-4-2-1-3-5-12/h1-9H,10-11H2
InChI Key:
VVVCJKKPLCVZOO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)C1(OCCO1)c1ccccc1
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.084g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.272g/mol
Monoisotopic Mass:
271.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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