Formula |
C19H19ClNO6S- |
IUPAC Name |
2-[[2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoyl]amino]ethanesulfonate |
Molecular Mass |
424.875 g·mol−1 |
Heat of Formation |
1372.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.13 ± 1.08 D |
Volume |
373.64 Å 3 |
Surface Area |
344.28 Å 2 |
HOMO Energy |
-8.65 ± 0.55 eV |
LUMO Energy |
-2.56 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[[2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-propanoyl]amino]ethanesulfonate
- 2-[[2-[4-(4-chlorophenyl)carbonylphenoxy]-2-methyl-propanoyl]amino]ethanesulfonate
- 2-[[2-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2-methyl-1-oxopropyl]amino]ethanesulfonate
- alfa-1081
- alpha-1081
- ethanesulfonic acid, 2-((2-(4-(4-chlorobenzoyl)phenoxy)-2-methyl-1-oxopropyl)amino)-, compd. with cholestyramine
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CAS Number(s) |
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InChIKey |
IYNIXDBLAVOMAW-UHFFFAOYSA-M |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
S
N
C
O
Cl
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