Back to Search
N,2-Dimethyl-2-Propanamine
CAS: 14610-37-8 | C5H13N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
14610-37-8
Molecular Formula:
C5H13N
Molecular Mass:
87.17 g/mol
Names and Synonyms:
N,2-Dimethyl-2-Propanamine
2-Propanamine, N,2-dimethyl-
Ethylamine, N,1,1-trimethyl-
N,2-Dimethyl-2-propanamine
N-Methyl-tert-butylamine
tert-Butylmethylamine
Methyl-tert-butylamine
N-tert-Butylmethylamine
N,1,1-Trimethylethylamine
N-tert-Butyl-N-methylamine
NSC 225080
N-Methyl-N-tert-butylamine
N-Methyl-2-(methyl)propan-2-amine
Identifiers:
SMILES:
CNC(C)(C)C
InChI:
InChI=1S/C5H13N/c1-5(2,3)6-4/h6H,1-4H3
Key Properties
Boiling Point
58-60 °C
CAS Common Chemistry
Density
0.73 g/cm³
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 | 87.17 g/mol | CAS Common Chemistry |
| 87.166 g/mol | RDKit | |
| 87.10479941599999 g/mol | RDKit | |
| Density | 0.73 g/cm³ | CAS Common Chemistry |
| 0.727 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Boiling Point | 58-60 °C | CAS Common Chemistry |
| Canonical SMILES | N(C)C(C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C5H13N/c1-5(2,3)6-4/h6H,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZQGJEUVBUVKZKS-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N,2-Dimethyl-2-propanamine | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 12.03 Ų | RDKit |
| LogP | 1.0043 | RDKit |
| Molar Refractivity | 28.812699999999985 | RDKit |
