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Lidocaine
CAS: 137-58-6 | C14H22N2O
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
137-58-6
Molecular Formula:
C14H22N2O
Molecular Mass:
234.34 g/mol
Names and Synonyms:
Lidocaine
Acetamide, 2-(diethylamino)-N-(2,6-dimethylphenyl)-
2′,6′-Acetoxylidide, 2-(diethylamino)-
2-(Diethylamino)-N-(2,6-dimethylphenyl)acetamide
α-Diethylamino-2,6-acetoxylidide
2-(Diethylamino)-2′,6′-acetoxylidide
Isicaine
Leostesin
Lidocaine
Lignocaine
Maricaine
Rucaina
Xycaine
Xylocaine
Xylocitin
Duncaine
Xylestesin
Anestacon
Solcain
Xylocain
Isicaina
Xilina
Xyline
Remicaine
Medicaine
Jetocaine
Lidoderm
Cuivasil
Dalcaine
Solarcaine
Lida-Mantle
NSC 40030
Lidocadren
Esracaine
Penles
LMX
ELA-Max
Aritmal
Trachisan
Linisol
Xylovet
Versatis
Xybrex
LidoPosterine
Lidocain
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)
Key Properties
Boiling Point
159-160 °C @ Press: 2 Torr
CAS Common Chemistry
Melting Point
68.5 °C
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 234.34 g/mol | CAS Common Chemistry |
| 234.343 g/mol | RDKit | |
| 234.173213324 g/mol | RDKit | |
| Boiling Point | 159-160 °C @ Press: 2 Torr | CAS Common Chemistry |
| Canonical SMILES | O=C(NC=1C(=CC=CC1C)C)CN(CC)CC | CAS Common Chemistry |
| 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) | CAS Common Chemistry |
| InChI Key | InChIKey=NNJVILVZKWQKPM-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 68.5 °C | CAS Common Chemistry |
| Name | Lidocaine | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 35.83 Ų | RDKit |
| LogP | 3.2332400000000012 | RDKit |
| Molar Refractivity | 73.42780000000005 | RDKit |
