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178625-01-9

178625-01-9 | 2-Propen-1-one, 1-(2-fluorophenyl)-3-(2-nitrophenyl)-

CAS No: 178625-01-9 Catalog No: AG00266P MDL No:

Product Description

Catalog Number:
AG00266P
Chemical Name:
2-Propen-1-one, 1-(2-fluorophenyl)-3-(2-nitrophenyl)-
CAS Number:
178625-01-9
Molecular Formula:
C15H10FNO3
Molecular Weight:
271.2432
IUPAC Name:
1-(2-fluorophenyl)-3-(2-nitrophenyl)prop-2-en-1-one
InChI:
InChI=1S/C15H10FNO3/c16-13-7-3-2-6-12(13)15(18)10-9-11-5-1-4-8-14(11)17(19)20/h1-10H
InChI Key:
BANHTWWNXPULGO-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1F)C=Cc1ccccc1[N+](=O)[O-]

Properties

Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.064g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.247g/mol
Monoisotopic Mass:
271.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.6  

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