Formula |
C22H21ClN2O5 |
IUPAC Name |
methyl 2-[2-chloro-6-ethoxy-4-[(e)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]acetate |
Molecular Mass |
428.866 g·mol−1 |
Heat of Formation |
-448.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.83 ± 1.08 D |
Volume |
486.9 Å 3 |
Surface Area |
428.83 Å 2 |
HOMO Energy |
-8.64 ± 0.55 eV |
LUMO Energy |
1.68 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[2-chloro-6-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenoxy]acetic acid methyl ester
- 2-[2-chloro-6-ethoxy-4-[(5-keto-3-methyl-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]acetic acid methyl ester
- methyl 2-[2-chloro-6-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]acetate
- methyl 2-[2-chloro-6-ethoxy-4-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenoxy]ethanoate
- methyl 2-[2-chloro-6-ethoxy-4-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenoxy]acetate
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InChIKey |
RKKFQJXGAQWHBZ-LICLKQGHSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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