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Home > Nitro Compounds > 17683-99-7
17683-99-7 | 2-Propenoic acid, 3-(4-nitrophenyl)-3-phenyl-
CAS No: 17683-99-7 Catalog No: AG0024XC MDL No:
Product Description
Catalog Number:
AG0024XC
Chemical Name:
2-Propenoic acid, 3-(4-nitrophenyl)-3-phenyl-
CAS Number:
17683-99-7
Molecular Formula:
C15H11NO4
Molecular Weight:
269.2521
IUPAC Name:
3-(4-nitrophenyl)-3-phenylprop-2-enoic acid
InChI:
InChI=1S/C15H11NO4/c17-15(18)10-14(11-4-2-1-3-5-11)12-6-8-13(9-7-12)16(19)20/h1-10H,(H,17,18)
InChI Key:
LDKNEGCCRUVKMM-UHFFFAOYSA-N
SMILES:
OC(=O)C=C(c1ccccc1)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.069g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.256g/mol
Monoisotopic Mass:
269.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.6
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