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4-(Benzyloxy)-3-Nitrobenzoic Acid
[CAS# 17903-89-8]

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Identification
Name 4-(Benzyloxy)-3-Nitrobenzoic Acid
Synonyms 3-nitro-4-benzyloxy benzoic acid; 4-BENZYLOXY-3-NITROBENZOIC ACID
Molecular Structure CAS#: 17903-89-8, 4-(Benzyloxy)-3-Nitrobenzoic Acid
Molecular Formula C14H11NO5
Molecular Weight 273.24
CAS Registry Number 17903-89-8
SMILES OC(=O)c2ccc(OCc1ccccc1)c(c2)N(=O)=O
InChI 1S/C14H11NO5/c16-14(17)11-6-7-13(12(8-11)15(18)19)20-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChIKey ZPGYWCMZSUFFFM-UHFFFAOYSA-N
Properties
Density 1.376g/cm3 (Cal.)
Boiling point 471.372°C at 760 mmHg (Cal.)
Flash point 238.877°C (Cal.)
Refractive index 1.632 (Cal.)
References
(1) Sarika Sivakumar, M. L. P. Reddy, Alan H. Cowley and Kalyan V. Vasudevan. Synthesis and crystal structures of lanthanide 4-benzyloxy benzoates: Influence of electron-withdrawing and electron-donating groups on luminescent properties, Dalton Trans., 2010, 39, 776.
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