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Lidocaine
CAS: 137-58-6 | C14H22N2O
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
137-58-6
Molecular Formula:
C14H22N2O
Molecular Weight:
234.343 g/mol
Names and Synonyms:
Lidocaine
Lidocain
LidoPosterine
Xybrex
Versatis
Xylovet
Linisol
Trachisan
Aritmal
ELA-Max
LMX
Penles
Esracaine
Lidocadren
NSC 40030
Lida-Mantle
Solarcaine
Dalcaine
Cuivasil
Lidoderm
Jetocaine
Medicaine
Remicaine
Xyline
Xilina
Isicaina
Xylocain
Solcain
Anestacon
Xylestesin
Duncaine
Xylocitin
Xylocaine
Xycaine
Rucaina
Maricaine
Lignocaine
Lidocaine
Leostesin
Isicaine
2-(Diethylamino)-2′,6′-acetoxylidide
α-Diethylamino-2,6-acetoxylidide
2-(Diethylamino)-N-(2,6-dimethylphenyl)acetamide
2′,6′-Acetoxylidide, 2-(diethylamino)-
Acetamide, 2-(diethylamino)-N-(2,6-dimethylphenyl)-
Identifiers:
SMILES:
CCN(CC)CC(O)=Nc1c(C)cccc1C
InChI:
InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 234.343 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 234.173213324 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 17 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 5 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 35.83 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 3.2332400000000012 | RDKit |
| molecular_mass | 234.34 g/mol | Legacy Database |
| cas-boiling-point | 159-160 °C @ Press: 2 Torr None | Legacy Database |
| cas-canonical-smile | O=C(NC=1C(=CC=CC1C)C)CN(CC)CC None | Legacy Database |
| cas-inchi | InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17) None | Legacy Database |
| cas-inchi-key | InChIKey=NNJVILVZKWQKPM-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 68.5 °C None | Legacy Database |
| cas-name | Lidocaine None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 73.42780000000005 | RDKit |
