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3-Tert-Butyl-4-Nitrobiphenyl
[CAS# 70634-28-5]

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Identification
Name 3-Tert-Butyl-4-Nitrobiphenyl
Synonyms 2-Tert-Butyl-1-Nitro-4-Phenyl-Benzene; 3-(1,1-Dimethylethyl)-4-Nitro-1,1'-Biphenyl; Ccris 8747
Molecular Structure CAS#: 70634-28-5, 3-Tert-Butyl-4-Nitrobiphenyl
Molecular Formula C16H17NO2
Molecular Weight 255.32
CAS Registry Number 70634-28-5
SMILES C2=C(C1=CC=CC=C1)C=CC(=C2C(C)(C)C)[N+]([O-])=O
InChI 1S/C16H17NO2/c1-16(2,3)14-11-13(9-10-15(14)17(18)19)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey OJGOKBGRPKCDBD-UHFFFAOYSA-N
Properties
Density 1.095g/cm3 (Cal.)
Boiling point 383.027°C at 760 mmHg (Cal.)
Flash point 168.611°C (Cal.)
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