CAS No.: 103-33-3 — Azobenzene (偶氮苯)

1. Primary Information

English name:	Azobenzene
CAS No.:	103-33-3
Molecular formula:	C₁₂H₁₀N₂
Molecular weight:	182.22 g/mol
SMILES:	C1=CC=C(C=C1)N=NC2=CC=CC=C2
Structural class:
Other identifiers:	azobenzene azobenzene, (E)-isomer azobenzene, (Z)-isomer azobenzene, T-labeled

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1.2ml	1000μg/ml in dichloromethane	464	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 24 25 0 0 0 0 0 0 0999 V2000 0.3151 -0.0002 -0.5421 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -0.0002 0.5411 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6982 -0.0001 -0.2925 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 0.0000 0.2933 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3776 -1.2080 -0.1699 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3786 -1.2080 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3773 1.2079 -0.1701 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3782 1.2079 0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7503 -1.2079 0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7514 -1.2079 -0.0776 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 1.2081 0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7511 1.2081 -0.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4364 0.0001 0.2015 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4376 0.0001 -0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8508 -2.1536 -0.2656 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8528 -2.1546 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8503 2.1534 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8524 2.1543 0.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2849 -2.1484 0.1741 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2859 -2.1484 -0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2845 2.1487 0.1737 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2855 2.1487 -0.1733 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5053 0.0002 0.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5065 0.0002 -0.3935 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 7 1 0 0 0 0 4 6 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 10 1 0 0 0 0 6 16 1 0 0 0 0 7 11 2 0 0 0 0 7 17 1 0 0 0 0 8 12 2 0 0 0 0 8 18 1 0 0 0 0 9 13 2 0 0 0 0 9 19 1 0 0 0 0 10 14 2 0 0 0 0 10 20 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 14 24 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

diphenyldiazene

4.2 InChI

InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H

4.3 InChIKey

DMLAVOWQYNRWNQ-UHFFFAOYSA-N

4.4 Canonical SMILES

C1=CC=C(C=C1)N=NC2=CC=CC=C2

4.5 Isomeric SMILES

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)