Formula |
C21H19Cl2NO7 |
IUPAC Name |
(4r)-4-(benzyloxycarbonylamino)-6-(2,6-dichlorobenzoyl)oxy-5-oxo-hexanoic acid |
Molecular Mass |
468.284 g·mol−1 |
Heat of Formation |
-1140.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.23 ± 1.08 D |
Volume |
503.25 Å 3 |
Surface Area |
435.31 Å 2 |
HOMO Energy |
-9.76 ± 0.55 eV |
LUMO Energy |
-1.17 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (4r)-4-(benzyloxycarbonylamino)-6-(2,6-dichlorobenzoyl)oxy-5-keto-hexanoic acid
- (4r)-6-(2,6-dichlorobenzoyl)oxy-5-oxo-4-(phenylmethoxycarbonylamino)hexanoic acid
- (4r)-6-(2,6-dichlorophenyl)carbonyloxy-5-oxo-4-(phenylmethoxycarbonylamino)hexanoic acid
- (4r)-6-[(2,6-dichlorophenyl)-oxomethoxy]-5-oxo-4-[[oxo-(phenylmethoxy)methyl]amino]hexanoic acid
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InChIKey |
PJUJOVPKUAZVRY-MRXNPFEDSA-N |
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Links |
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Elements |
H
C
N
O
Cl
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