C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]
CAS: 7497-60-1
Name: (4-chlorophenyl)-(4-nitrophenyl)methanone
SMILES: C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

Molecular Processing

Molecular formula
C13H8ClNO3
Molecular weight
261.66
Exact mass
261.0193
XLogP
3.48
TPSA
60.21
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
67.98

Supplementary Information

InChIKey: CLFRUWPJQKSRRT-UHFFFAOYSA-N
Synonyme
4-Chloro-4'-nitrobenzophenone7497-60-1DTXSID60324395RefChem:291697DTXCID80275512(4-chlorophenyl)(4-nitrophenyl)methanoneMethanone,(4-chlorophenyl)(4-nitrophenyl)-(4-chlorophenyl)-(4-nitrophenyl)methanoneMFCD000477434'-chloro-4-nitrobenzophenone4-nitro-4'-chlorobenzophenoneNSC 406624NSC406624Oprea1_296759SCHEMBL1810147CLFRUWPJQKSRRT-UHFFFAOYSA-NSTK2662544-chlorophenyl-4-nitrophenyl-methanoneAKOS001482634NSC-406624AS-10651SY130681DB-023109CS-0197411Y11169F2016354-Chloro-4 inverted exclamation mark -nitrobenzophenone
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