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3-Amino-9-Ethylcarbazole
CAS: 132-32-1 | C14H14N2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
132-32-1
Molecular Formula:
C14H14N2
Molecular Mass:
210.28 g/mol
Names and Synonyms:
3-Amino-9-Ethylcarbazole
3-Amino-N-ethylcarbazole
9-Ethyl-3-carbazolamine
9-Ethyl-9H-carbazol-3-ylamine
NSC 67709
NSC 96640
AEC
AEC (chromogen)
9-Ethyl-9H-carbazole-3-amine
3-Amino-9-ethyl-9H-carbazole
N-(9-Ethyl-9H-carbazol-3-yl)amine
9H-Carbazol-3-amine, 9-ethyl-
Carbazole, 3-amino-9-ethyl-
9-Ethyl-9H-carbazol-3-amine
3-Amino-9-ethylcarbazole
Identifiers:
SMILES:
CCn1c2ccccc2c2cc(N)ccc21
InChI:
InChI=1S/C14H14N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9H,2,15H2,1H3
Key Properties
Melting Point
127 °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 | 210.28 g/mol | CAS Common Chemistry |
| 210.27999999999997 g/mol | RDKit | |
| 210.115698448 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/3-Amino-9-ethylcarbazole | CAS Common Chemistry |
| Canonical SMILES | NC1=CC=C2C(=C1)C=3C=CC=CC3N2CC | CAS Common Chemistry |
| InChI | InChI=1S/C14H14N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9H,2,15H2,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=OXEUETBFKVCRNP-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 127 °C | CAS Common Chemistry |
| Name | 3-Amino-9-ethylcarbazole | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 3 | RDKit |
| Topological Polar Surface Area | 30.95 Ų | RDKit |
| LogP | 3.396600000000001 | RDKit |
| Molar Refractivity | 69.53040000000003 | RDKit |
