Formula |
C16H23ClN2O3 |
IUPAC Name |
3-(1-piperidyl)propyl 4-amino-5-chloro-2-methoxy-benzoate |
Molecular Mass |
326.818 g·mol−1 |
Heat of Formation |
-512.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.42 ± 1.08 D |
Volume |
388.14 Å 3 |
Surface Area |
354.96 Å 2 |
HOMO Energy |
-8.78 ± 0.55 eV |
LUMO Energy |
-0.39 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- 3-piperidin-1-ylpropyl 4-amino-5-chloro-2-methoxy-benzoate
- 3-piperidin-1-ylpropyl 4-amino-5-chloro-2-methoxybenzoate
- 4-amino-5-chloro-2-methoxy-benzoic acid 3-piperidinopropyl ester
- 4-amino-5-chloro-2-methoxybenzoic acid 3-(1-piperidyl)propyl ester
- biomol-nt_000148
- bpbio1_000529
- tocris-0728
|
InChIKey |
RLSGBCUXLRMTPF-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
N
O
Cl
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