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Home > Nitro Compounds > 898786-24-8
898786-24-8 | 3-(1,3-DIOXAN-2-YL)-4'-NITROPROPIOPHENONE
CAS No: 898786-24-8 Catalog No: AG00GYZH MDL No:
Product Description
Catalog Number:
AG00GYZH
Chemical Name:
3-(1,3-DIOXAN-2-YL)-4'-NITROPROPIOPHENONE
CAS Number:
898786-24-8
IUPAC Name:
3-(1,3-dioxan-2-yl)-1-(4-nitrophenyl)propan-1-one
InChI:
InChI=1S/C13H15NO5/c15-12(6-7-13-18-8-1-9-19-13)10-2-4-11(5-3-10)14(16)17/h2-5,13H,1,6-9H2
InChI Key:
BUXYMCQTJRUEAI-UHFFFAOYSA-N
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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