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1-Ethyl-2-nitrobenzene
[CAS# 30179-51-2]

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Identification
Name 1-Ethyl-2-nitrobenzene
Synonyms 1-Ethyl-2-Nitro-Benzene; Benzene, 1-Ethyl-2-Nitro-; Nsc5095
Molecular Structure CAS#: 30179-51-2, 1-Ethyl-2-nitrobenzene
Molecular Formula C8H9NO2
Molecular Weight 151.16
CAS Registry Number 30179-51-2
EINECS 250-083-4
SMILES C1=CC=CC(=C1[N+]([O-])=O)CC
InChI 1S/C8H9NO2/c1-2-7-5-3-4-6-8(7)9(10)11/h3-6H,2H2,1H3
InChIKey PXWYZLWEKCMTEZ-UHFFFAOYSA-N
Properties
Density 1.127g/cm3 (Cal.)
Boiling point 232.499°C at 760 mmHg (Cal.)
Flash point 86.868°C (Cal.)
References
(1) T. Schmierer, S. LaimgruberPresent address: TILL I.D. GmbH c/o BioImaging Zentrum (BIZ) der LMU München, Großhaderner Str. 2–4, 82152 Martinsried, Germany., K. Haiser, K. Kiewisch, J. Neugebauer and P. Gilch. Femtosecond spectroscopy on the photochemistry of ortho-nitrotoluene, Phys. Chem. Chem. Phys., 2010, 12, 15653.
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