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Home > Nitro Compounds > 358656-78-7
358656-78-7 | (2E)-3-(2-ethoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
CAS No: 358656-78-7 Catalog No: AG00JU4Q MDL No:MFCD01901486
Product Description
Catalog Number:
AG00JU4Q
Chemical Name:
(2E)-3-(2-ethoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
CAS Number:
358656-78-7
Molecular Formula:
C17H15NO4
Molecular Weight:
297.3053
MDL Number:
MFCD01901486
IUPAC Name:
(E)-3-(2-ethoxyphenyl)-1-(3-nitrophenyl)prop-2-en-1-one
InChI:
InChI=1S/C17H15NO4/c1-2-22-17-9-4-3-6-13(17)10-11-16(19)14-7-5-8-15(12-14)18(20)21/h3-12H,2H2,1H3/b11-10+
InChI Key:
DVOKYABWMUWQOO-ZHACJKMWSA-N
SMILES:
CCOc1ccccc1/C=C/C(=O)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
297.1g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.31g/mol
Monoisotopic Mass:
297.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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