Back to Search
(-)-1,2,3,4-Tetrahydro-1-Naphthylamine
CAS: 23357-46-2 | C10H13N
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
23357-46-2
Molecular Formula:
C10H13N
Molecular Weight:
147.22099999999998 g/mol
Names and Synonyms:
(-)-1,2,3,4-Tetrahydro-1-Naphthylamine
(R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine
(R)-1,2,3,4-Tetrahydro-1-naphthylamine
(R)-1-Amino-1,2,3,4-tetrahydronaphthalene
(R)-1,2,3,4-Tetrahydronaphthalen-1-amine
(1R)-1-Aminotetralin
(R)-1,2,3,4-Tetrahydro-1-naphthalenamine
(1R)-1,2,3,4-Tetrahydro-1-naphthalenamine
(R)-(-)-1-Amino-1,2,3,4-tetrahydronaphthalene
(-)-1-Aminotetralin
(R)-1-Aminotetralin
(R)-1,2,3,4-Tetrahydro-1-naphthylamine
(-)-1,2,3,4-Tetrahydro-1-naphthalenamine
(R)-(-)-1,2,3,4-Tetrahydro-1-aminonaphthalene
(R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine
(-)-1,2,3,4-Tetrahydro-1-naphthylamine
(R)-(-)-1-Aminotetralin
(1R)-1,2,3,4-Tetrahydro-1-naphthalenamine
1-Naphthalenamine, 1,2,3,4-tetrahydro-, (R)-
1-Naphthylamine, 1,2,3,4-tetrahydro-, (R)-(-)-
1-Naphthalenamine, 1,2,3,4-tetrahydro-, (1R)-
Identifiers:
SMILES:
N[C@@H]1CCCc2ccccc21
InChI:
InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2/t10-/m1/s1
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 | 147.22099999999998 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 147.104799416 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 11 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 26.02 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 2.0227000000000004 | RDKit |
| molecular_mass | 147.22 g/mol | Legacy Database |
| cas-canonical-smile | NC1C=2C=CC=CC2CCC1 None | Legacy Database |
| cas-inchi | InChI=1S/C10H13N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6,10H,3,5,7,11H2/t10-/m1/s1 None | Legacy Database |
| cas-inchi-key | InChIKey=JRZGPXSSNPTNMA-SNVBAGLBSA-N None | Legacy Database |
| cas-melting-point | 116-119 °C None | Legacy Database |
| cas-name | (-)-1,2,3,4-Tetrahydro-1-naphthylamine None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 46.30840000000002 | RDKit |
