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198879-98-0

198879-98-0 | Cyclohexanecarboxamide, N-(4-fluoro-3-nitrophenyl)-

CAS No: 198879-98-0 Catalog No: AG002BRV MDL No:

Product Description

Catalog Number:
AG002BRV
Chemical Name:
Cyclohexanecarboxamide, N-(4-fluoro-3-nitrophenyl)-
CAS Number:
198879-98-0
Molecular Formula:
C13H15FN2O3
Molecular Weight:
266.2682
IUPAC Name:
N-(4-fluoro-3-nitrophenyl)cyclohexanecarboxamide
InChI:
InChI=1S/C13H15FN2O3/c14-11-7-6-10(8-12(11)16(18)19)15-13(17)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,15,17)
InChI Key:
JNVZXVGJUXSANR-UHFFFAOYSA-N
SMILES:
O=C(C1CCCCC1)Nc1ccc(c(c1)[N+](=O)[O-])F

Properties

Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.107g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
266.272g/mol
Monoisotopic Mass:
266.107g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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