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Acetic Acid 4-Nitrobenzyl Ester
[CAS# 619-90-9]

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Identification
Name Acetic Acid 4-Nitrobenzyl Ester
Synonyms Acetic Acid (4-Nitrophenyl)Methyl Ester; Acetic Acid (4-Nitrobenzyl) Ester; (4-Nitrophenyl)Methyl Ethanoate
Molecular Formula C9H9NO4
Molecular Weight 195.17
CAS Registry Number 619-90-9
EINECS 210-618-4
SMILES C1=C(C=CC(=C1)COC(C)=O)[N+](=O)[O-]
InChI 1S/C9H9NO4/c1-7(11)14-6-8-2-4-9(5-3-8)10(12)13/h2-5H,6H2,1H3
InChIKey QNXQLPUEZYZYFC-UHFFFAOYSA-N
Properties
Density 1.267g/cm3 (Cal.)
Melting point 78°C (Expl.)
Boiling point 305.074°C at 760 mmHg (Cal.)
Flash point 141.433°C (Cal.)
Safety Data
SDS Available
References
(1) Philip Prathipati, Ngai Ling Ma* and Thomas H. Keller. Global Bayesian Models for the Prioritization of Antitubercular Agents, J. Chem. Inf. Model., 2008, 48 (12), pp 2362–2370
Market Analysis Reports
List of Reports Available for Acetic Acid 4-Nitrobenzyl Ester
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