4-Nitro-2-phenylbenzoic acid tert-butyl ester

Base Information

• Chemical Name: 4-Nitro-2-phenylbenzoic acid tert-butyl ester
• CAS No.: 191105-38-1
• Molecular Formula: C₁₇H₁₇NO₄
• Molecular Weight: 299.326
• DSSTox Substance ID: DTXSID601209986
• Mol file: 191105-38-1.mol

Synonyms:4-nitro-2-phenylbenzoic acid tert-butyl ester;SCHEMBL6781827;IQJWAFAGQFXVPH-UHFFFAOYSA-N;DTXSID601209986;191105-38-1;1,1-Dimethylethyl 5-nitro[1,1'-biphenyl]-2-carboxylate

Chemical Property of 4-Nitro-2-phenylbenzoic acid tert-butyl ester

Chemical Property:

• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 299.11575802
• Heavy Atom Count: 22
• Complexity: 404

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)C1=C(C=C(C=C1)[N+](=O)[O-])C2=CC=CC=C2