Formula |
C10H10ClNO4 |
IUPAC Name |
2-chloroethyl 4-methyl-3-nitro-benzoate |
Molecular Mass |
243.644 g·mol−1 |
Heat of Formation |
-364.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.45 ± 1.08 D |
Volume |
265.0 Å 3 |
Surface Area |
248.46 Å 2 |
HOMO Energy |
-10.60 ± 0.55 eV |
LUMO Energy |
-1.46 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-chloroethyl 3-nitro-p-toluate
- 4-methyl-3-nitro-benzoic acid 2-chloroethyl ester
- 4-methyl-3-nitrobenzoic acid 2-chloroethyl ester
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CAS Number(s) |
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InChIKey |
FHTNGTPVGWEJPG-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
Cl
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