Formula |
C8H17NO2 |
IUPAC Name |
(3s)-3-(aminomethyl)-5-methyl-hexanoic acid |
Molecular Mass |
159.226 g·mol−1 |
Heat of Formation |
-510.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.86 ± 1.08 D |
Volume |
218.19 Å 3 |
Surface Area |
204.91 Å 2 |
HOMO Energy |
-9.57 ± 0.55 eV |
LUMO Energy |
0.84 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (3s)-3-(aminomethyl)-5-methyl-hexanoic acid
- (3s)-3-(aminomethyl)-5-methylhexanoic acid
- (r-)-3-isobutyl gaba
- 3-isobutyl gaba
- d02716
- hexanoic acid, 3-(aminomethyl)-5-methyl-, (s)-
- pd 144723
- pregabalin (usan)
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CAS Number(s) |
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InChIKey |
AYXYPKUFHZROOJ-ZETCQYMHSA-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
N
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