Formula |
C18H17ClO3 |
IUPAC Name |
4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butanoic acid |
Molecular Mass |
316.779 g·mol−1 |
Heat of Formation |
-471.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.04 ± 1.08 D |
Volume |
370.68 Å 3 |
Surface Area |
325.99 Å 2 |
HOMO Energy |
-9.61 ± 0.55 eV |
LUMO Energy |
-0.87 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-(2-methyl-3-(4-chlorobenzoyl)phenyl)butanoic acid
- 4-[3-(4-chlorobenzoyl)-2-methyl-phenyl]butyric acid
- 4-[3-(4-chlorophenyl)carbonyl-2-methyl-phenyl]butanoic acid
- 4-[3-[(4-chlorophenyl)-oxomethyl]-2-methylphenyl]butanoic acid
- benzenebutanoic acid, 3-(4-chlorobenzoyl)-2-methyl-
- ru 16029
- ru-16029
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CAS Number(s) |
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InChIKey |
IFJDHARPMATWIG-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
O
Cl
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