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1-(3'-Nitro-4-Biphenylyl)Ethanone
[CAS# 5002-11-9]

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Identification
Name 1-(3'-Nitro-4-Biphenylyl)Ethanone
Synonyms 1-(3'-nitro-1,1'-biphenyl-4-yl)ethanone; 1-(3'-nitro-1,1'-biphenyl-4-yl)ethanone (en); ZINC03848636
Molecular Structure CAS#: 5002-11-9, 1-(3'-Nitro-4-Biphenylyl)Ethanone
Molecular Formula C14H11NO3
Molecular Weight 241.24
CAS Registry Number 5002-11-9
SMILES [O-][N+](=O)c2cccc(c1ccc(C(=O)C)cc1)c2
InChI 1S/C14H11NO3/c1-10(16)11-5-7-12(8-6-11)13-3-2-4-14(9-13)15(17)18/h2-9H,1H3
InChIKey BRTDOUVNXYDWDL-UHFFFAOYSA-N
Properties
Density 1.218g/cm3 (Cal.)
Melting point 107-108°C (Expl.)
Boiling point 399.043°C at 760 mmHg (Cal.)
Flash point 190.528°C (Cal.)
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