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Solvent Yellow 34
CAS: 492-80-8 | C17H21N3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
492-80-8
Molecular Formula:
C17H21N3
Molecular Mass:
267.38 g/mol
Names and Synonyms:
Solvent Yellow 34
Benzenamine, 4,4′-carbonimidoylbis[N,N-dimethyl-
C.I. Solvent Yellow 34
4,4′-Carbonimidoylbis[N,N-dimethylbenzenamine]
C.I. 41000B
Auramine N Base
Auramine O Base
Auramine SS
Brilliant Oil Yellow
4,4′-Dimethylaminobenzophenonimide
Waxoline Yellow O
Auramine base
Auramine OAF
Baso Yellow 124
Orient Oil Yellow 101
4,4′-(Imidocarbonyl)bis(N,N-dimethylaniline)
Solvent Yellow 34
Auramine S
Identifiers:
SMILES:
CN(C)c1ccc(C(=N)c2ccc(N(C)C)cc2)cc1
InChI:
InChI=1S/C17H21N3/c1-19(2)15-9-5-13(6-10-15)17(18)14-7-11-16(12-8-14)20(3)4/h5-12,18H,1-4H3
Key Properties
Boiling Point
330.5 °C
CAS Common Chemistry
Melting Point
136 °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 | 267.38 g/mol | CAS Common Chemistry |
| 267.376 g/mol | RDKit | |
| 267.173547672 g/mol | RDKit | |
| Boiling Point | 330.5 °C | CAS Common Chemistry |
| Canonical SMILES | N=C(C1=CC=C(C=C1)N(C)C)C2=CC=C(C=C2)N(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C17H21N3/c1-19(2)15-9-5-13(6-10-15)17(18)14-7-11-16(12-8-14)20(3)4/h5-12,18H,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=JPIYZTWMUGTEHX-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 136 °C | CAS Common Chemistry |
| Name | Solvent Yellow 34 | CAS Common Chemistry |
| Heavy Atom Count | 20 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 30.330000000000005 Ų | RDKit |
| LogP | 3.234770000000002 | RDKit |
| Molar Refractivity | 87.46870000000004 | RDKit |
