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114235-54-0 | Benzaldehyde, 2-[2-(2-nitrosophenyl)ethyl]-
CAS No: 114235-54-0 Catalog No: AG000AVS MDL No:
Product Description
Catalog Number:
AG000AVS
Chemical Name:
Benzaldehyde, 2-[2-(2-nitrosophenyl)ethyl]-
CAS Number:
114235-54-0
Molecular Formula:
C15H13NO2
Molecular Weight:
239.2692
IUPAC Name:
2-[2-(2-nitrosophenyl)ethyl]benzaldehyde
InChI:
InChI=1S/C15H13NO2/c17-11-14-7-2-1-5-12(14)9-10-13-6-3-4-8-15(13)16-18/h1-8,11H,9-10H2
InChI Key:
YUDNIRVWVXSVPX-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1CCc1ccccc1N=O
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.274g/mol
Monoisotopic Mass:
239.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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